3-acetamido-N-{N'-(3-chloro-2-methylphenyl)-N-[(pyridin-2-yl)methyl]carbamimidoyl}-4-methylbenzamide
Chemical Structure Depiction of
3-acetamido-N-{N'-(3-chloro-2-methylphenyl)-N-[(pyridin-2-yl)methyl]carbamimidoyl}-4-methylbenzamide
3-acetamido-N-{N'-(3-chloro-2-methylphenyl)-N-[(pyridin-2-yl)methyl]carbamimidoyl}-4-methylbenzamide
Compound characteristics
| Compound ID: | L086-0396 |
| Compound Name: | 3-acetamido-N-{N'-(3-chloro-2-methylphenyl)-N-[(pyridin-2-yl)methyl]carbamimidoyl}-4-methylbenzamide |
| Molecular Weight: | 449.94 |
| Molecular Formula: | C24 H24 Cl N5 O2 |
| Smiles: | CC(Nc1cc(ccc1C)C(NC(/NCc1ccccn1)=N/c1cccc(c1C)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1856 |
| logD: | 3.0404 |
| logSw: | -3.4898 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 73.261 |
| InChI Key: | UPUQSDMYHAARMK-UHFFFAOYSA-N |