N-{N'-(3-chloro-4-fluorophenyl)-N-[(pyridin-3-yl)methyl]carbamimidoyl}-3,5-dimethoxybenzamide
Chemical Structure Depiction of
N-{N'-(3-chloro-4-fluorophenyl)-N-[(pyridin-3-yl)methyl]carbamimidoyl}-3,5-dimethoxybenzamide
N-{N'-(3-chloro-4-fluorophenyl)-N-[(pyridin-3-yl)methyl]carbamimidoyl}-3,5-dimethoxybenzamide
Compound characteristics
| Compound ID: | L087-1034 |
| Compound Name: | N-{N'-(3-chloro-4-fluorophenyl)-N-[(pyridin-3-yl)methyl]carbamimidoyl}-3,5-dimethoxybenzamide |
| Molecular Weight: | 442.88 |
| Molecular Formula: | C22 H20 Cl F N4 O3 |
| Smiles: | COc1cc(cc(c1)OC)C(NC(/NCc1cccnc1)=N/c1ccc(c(c1)[Cl])F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6545 |
| logD: | 3.6414 |
| logSw: | -4.1202 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.457 |
| InChI Key: | DNCFZTNALVULHY-UHFFFAOYSA-N |