| CAS Number | 926194-69-6 |
| Catalog Number | AG01A8RT |
| Chemical Name | 2-amino-5-chloro-N-(pyridin-4-yl)benzamide |
| IUPAC Name | 2-amino-5-chloro-N-pyridin-4-ylbenzamide |
| InChI | InChI=1S/C12H10ClN3O/c13-8-1-2-11(14)10(7-8)12(17)16-9-3-5-15-6-4-9/h1-7H,14H2,(H,15,16,17) |
| InChI Key | OYKWUJOBUQZDIC-UHFFFAOYSA-N |
| MDL Number | MFCD09042865 |
| Molecular Formula | C12H10ClN3O |
| Molecular Weight | 247.6803 |
| SMILES | NC1=C(C(NC2=CC=NC=C2)=O)C=C(Cl)C=C1 |
| Synonyms | 2-amino-5-chloro-N-(pyridin-4-yl)benzamide,
926194-69-6,
AC1Q50R5,
CTK6G7498,
ZINC21953888,
AKOS000127257,
MCULE-6012902444,
NE18814,
EN300-62399,
2-AMINO-5-CHLORO-N-PYRIDIN-4-YLBENZAMIDE,
Z927753096,
|
| Complexity | 269 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 247.051g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 247.682g/mol |
| Monoisotopic Mass | 247.051g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 68A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number