| CAS Number | 173897-49-9 |
| Catalog Number | AG019XSP(AGN-PC-0QAFEY) |
| Chemical Name | 4-(aminomethyl)-N-(pyridin-4-yl)benzamide dihydrochloride |
| IUPAC Name | 4-(aminomethyl)-N-pyridin-4-ylbenzamide;dihydrochloride |
| InChI | InChI=1S/C13H13N3O.2ClH/c14-9-10-1-3-11(4-2-10)13(17)16-12-5-7-15-8-6-12;;/h1-8H,9,14H2,(H,15,16,17);2*1H |
| InChI Key | SJUJLJALMMIXKU-UHFFFAOYSA-N |
| MDL Number | MFCD13196312 |
| Molecular Formula | C13H15Cl2N3O |
| Molecular Weight | 300.1837 |
| SMILES | Cl.Cl.NCC1=CC=C(C(NC2=CC=NC=C2)=O)C=C1 |
| Synonyms | 4-(aminomethyl)-N-(pyridin-4-yl)benzamide dihydrochloride,
173897-49-9,
AC1Q3ATV,
SCHEMBL5462828,
CTK7E4366,
SJUJLJALMMIXKU-UHFFFAOYSA-N,
AKOS008093580,
MCULE-9898979836,
NE18263,
EN300-55962,
N-(4-pyridyl)-4-aminomethylbenzamide dihydrochloride,
4-(aminomethyl)-N-pyridin-4-ylbenzamide dihydrochloride,
Z1184900314,
|
| Complexity | 243 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 299.059g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 300.183g/mol |
| Monoisotopic Mass | 299.059g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 68A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number