N-{N'-(3-chloro-4-methoxyphenyl)-N-[(pyridin-2-yl)methyl]carbamimidoyl}-3,5-dimethoxybenzamide
Chemical Structure Depiction of
N-{N'-(3-chloro-4-methoxyphenyl)-N-[(pyridin-2-yl)methyl]carbamimidoyl}-3,5-dimethoxybenzamide
N-{N'-(3-chloro-4-methoxyphenyl)-N-[(pyridin-2-yl)methyl]carbamimidoyl}-3,5-dimethoxybenzamide
Compound characteristics
| Compound ID: | L086-0921 |
| Compound Name: | N-{N'-(3-chloro-4-methoxyphenyl)-N-[(pyridin-2-yl)methyl]carbamimidoyl}-3,5-dimethoxybenzamide |
| Molecular Weight: | 454.91 |
| Molecular Formula: | C23 H23 Cl N4 O4 |
| Smiles: | COc1cc(cc(c1)OC)C(NC(/NCc1ccccn1)=N/c1ccc(c(c1)[Cl])OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7529 |
| logD: | 3.4151 |
| logSw: | -4.2046 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.112 |
| InChI Key: | PCEBOZTZQHKGQU-UHFFFAOYSA-N |