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| CAS Number | 86-22-6 |
| Catalog Number | AG004NGX(AGN-PC-0V34HT) |
| Chemical Name | 3-(4-Bromophenyl)-N,N-dimethyl-3-pyridin-2-ylpropan-1-amine |
| EC Number | 201-657-8 |
| IUPAC Name | 3-(4-bromophenyl)-N,N-dimethyl-3-pyridin-2-ylpropan-1-amine |
| InChI | InChI=1S/C16H19BrN2/c1-19(2)12-10-15(16-5-3-4-11-18-16)13-6-8-14(17)9-7-13/h3-9,11,15H,10,12H2,1-2H3 |
| InChI Key | ZDIGNSYAACHWNL-UHFFFAOYSA-N |
| MDL Number | MFCD00865691 |
| Molecular Formula | C16H19BrN2 |
| Molecular Weight | 319.2395 |
| SMILES | BrC1=CC=C(C=C1)C(CCN(C)C)C1=NC=CC=C1 |
| Synonyms | Brompheniramine,
Brompheniramine Maleate,
Brompheniramine Maleate (1:1),
Chlorphed,
Dimetane,
Dimetane Ten,
Dimetane-Ten,
Dimetapp Allergy,
Maleate, Brompheniramine,
Oraminic 2,
Oraminic-2,
p Bromdylamine,
p-Bromdylamine,
para Bromdylamine,
para-Bromdylamine,
BROMPHENIRAMINE,
Brompheniraminum,
Parabromdylamine,
Bromfeniramina,
86-22-6,
Ilvin,
Bromfed,
Dimetane,
Bromfenex,
Brompheniramine [INN:BAN],
Bromfeniramina [INN-Spanish],
Brompheniraminum [INN-Latin],
Parabromodylamine,
1-(p-Bromophenyl)-1-(2-pyridyl)-3-dimethylaminopropane,
3-(p-Bromophenyl)-3-(2-pyridyl)-N,N-dimethylpropylamine,
2-(p-Bromo-alpha-(2-dimethylaminoethyl)benzyl)pyridine,
Veltane,
Antihistamine compound,
HSDB 3017,
EINECS 201-657-8,
2-Pyridinepropanamine, .gamma.-(4-bromophenyl)-N,N-dimethyl-,
3-(4-Bromophenyl)-N,N-dimethyl-3-(2-pyridinyl)-1-propanamine,
3-(4-bromophenyl)-N,N-dimethyl-3-(pyridin-2-yl)propan-1-amine,
CHEMBL811,
CHEBI:3183,
gamma-(4-Bromophenyl)-N,N-dimethyl-2-pyridinepropanamine,
2-Pyridinepropanamine, gamma-(4-bromophenyl)-N,N-dimethyl-,
Lodrane,
Pyridine, 2-(p-bromo-alpha-(2-(dimethylamino)ethyl)benzyl)-,
3-(4-bromophenyl)-N,N-dimethyl-3-pyridin-2-ylpropan-1-amine,
Bromopheniramine,
p-Bromdylamine,
para-Bromdylamine,
[3-(4-bromophenyl)-3-(pyridin-2-yl)propyl]dimethylamine,
3-(4-bromophenyl)-N,N-dimethyl-3-(2-pyridyl)propan-1-amine,
Brotane (TN),
Brompheniramine Maleate (1:1),
Brompheniramine (INN),
Brompheniramin,
Dexbrompheniramine maleate salt,
Allent (Salt/Mix),
(?)-Brompheniramine,
Drauxin (Salt/Mix),
Dimetane (Salt/Mix),
Spectrum_001682,
SpecPlus_000750,
AC1L1NEM,
Prestwick0_000475,
Prestwick1_000475,
Prestwick2_000475,
Prestwick3_000475,
Spectrum2_001610,
Spectrum3_000981,
Spectrum4_001107,
Spectrum5_001537,
SCHEMBL4814,
Lopac0_000201,
Oprea1_690847,
BSPBio_000610,
BSPBio_002641,
KBioGR_001554,
KBioSS_002162,
DivK1c_006846,
SPBio_001619,
SPBio_002549,
[3-(4-Bromophenyl)-3-(2-pyridyl)propyl]dimethylamine,
BPBio1_000672,
GTPL7133,
DTXSID5022691,
CTK8F8346,
Dexbrompheniramine Brompheniramine,
KBio1_001790,
KBio2_002162,
KBio2_004730,
KBio2_007298,
KBio3_001861,
ZDIGNSYAACHWNL-UHFFFAOYSA-N,
HMS3604F03,
A6B359,
BDBM50017666,
MFCD00865691,
PDSP1_000146,
PDSP2_000145,
STL058559,
AKOS005711313,
API0009139,
CCG-204296,
DB00835,
NCGC00015146-04,
NCGC00015146-05,
NCGC00015146-07,
NCGC00015146-08,
NCGC00089782-02,
AC-15955,
AN-42337,
SBI-0050189.P003,
LS-130308,
LS-177900,
LS-187224,
AB00053703,
FT-0603299,
C06857,
D07543,
AB00053703_19,
AB00053703_20,
C-19601,
L001031,
BRD-A68723818-050-05-1,
BRD-A68723818-050-18-4,
2-[p-Bromo-.alpha.-[2-(dimethylamino)ethyl]benzyl]pyridine,
[3-(4-Bromo-phenyl)-3-pyridin-2-yl-propyl]-dimethyl-amine,
3-(4-bromophenyl)-N,N-dimethyl-3-pyridin-2-yl-propan-1-amine,
Pyridine, 2-[p-bromo-.alpha.-[2-(dimethylamino)ethyl]benzyl]-,
Brompheniramine maleate,
Dimetapp,
Dimetane-ten,
bromphen,
Dimetapp Allergy,
Teriflunomide,
Chlorphed,
Dexbrompheniramine,
Brotane,
brompheniramin-,
p Bromdylamine,
Dexbromfeniramina,
Dimetane Ten,
para Bromdylamine,
D-Brompheniramine,
Oraminic 2,
Oraminic-2,
Dexbrompheniraminum,
DIMETANE-DX,
BROMFED-DM,
Maleate, Brompheniramine,
UNII-H57G17P2FN,
C16H19BrN2,
D08VXO,
H57G17P2FN,
DEXBROMPHENIRAMINE MALEATE,
C16-H19-Br-N2,
CID6834,
CS-O-06170,
D001977,
2-[p-bromo-alpha-(2-dimethylaminoethyl)benzyl]pyridine,
BPN,
108605-62-5,
132-21-8,
|
| Complexity | 249 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 318.073g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 319.246g/mol |
| Monoisotopic Mass | 318.073g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 16.1A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.5 |
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