| CAS Number | 1019555-56-6 |
| Catalog Number | AG019V1I |
| Chemical Name | N-(4-{[(4-bromophenyl)methyl]amino}phenyl)acetamide |
| IUPAC Name | N-[4-[(4-bromophenyl)methylamino]phenyl]acetamide |
| InChI | InChI=1S/C15H15BrN2O/c1-11(19)18-15-8-6-14(7-9-15)17-10-12-2-4-13(16)5-3-12/h2-9,17H,10H2,1H3,(H,18,19) |
| InChI Key | BGMOMMDRSYTTAZ-UHFFFAOYSA-N |
| MDL Number | MFCD11858083 |
| Molecular Formula | C15H15BrN2O |
| Molecular Weight | 319.1964 |
| SMILES | CC(NC1=CC=C(NCC2=CC=C(Br)C=C2)C=C1)=O |
| Synonyms | N-(4-{[(4-bromophenyl)methyl]amino}phenyl)acetamide,
1019555-56-6,
AC1Q1KY9,
CTK6A0823,
ZINC19885761,
AKOS000227982,
MCULE-1262782992,
NE22045,
EN300-43467,
n-(4-([(4-bromophenyl)methyl]amino)phenyl)acetamide,
|
| Complexity | 282 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 318.037g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 319.202g/mol |
| Monoisotopic Mass | 318.037g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 41.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.3 |
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Certificate of Analysis
Lot Number