4-(acetamidomethyl)-N-{N'-(3-chloro-4-fluorophenyl)-N-[(pyridin-3-yl)methyl]carbamimidoyl}benzamide
Chemical Structure Depiction of
4-(acetamidomethyl)-N-{N'-(3-chloro-4-fluorophenyl)-N-[(pyridin-3-yl)methyl]carbamimidoyl}benzamide
4-(acetamidomethyl)-N-{N'-(3-chloro-4-fluorophenyl)-N-[(pyridin-3-yl)methyl]carbamimidoyl}benzamide
Compound characteristics
| Compound ID: | L087-1039 |
| Compound Name: | 4-(acetamidomethyl)-N-{N'-(3-chloro-4-fluorophenyl)-N-[(pyridin-3-yl)methyl]carbamimidoyl}benzamide |
| Molecular Weight: | 453.9 |
| Molecular Formula: | C23 H21 Cl F N5 O2 |
| Smiles: | CC(NCc1ccc(cc1)C(NC(/NCc1cccnc1)=N/c1ccc(c(c1)[Cl])F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8183 |
| logD: | 1.8042 |
| logSw: | -2.6898 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 75.953 |
| InChI Key: | VGNMNAUSFGTSMJ-UHFFFAOYSA-N |