N-{N'-(3-chloro-4-methoxyphenyl)-N-[(pyridin-2-yl)methyl]carbamimidoyl}-4-fluorobenzamide
Chemical Structure Depiction of
N-{N'-(3-chloro-4-methoxyphenyl)-N-[(pyridin-2-yl)methyl]carbamimidoyl}-4-fluorobenzamide
N-{N'-(3-chloro-4-methoxyphenyl)-N-[(pyridin-2-yl)methyl]carbamimidoyl}-4-fluorobenzamide
Compound characteristics
| Compound ID: | L086-0910 |
| Compound Name: | N-{N'-(3-chloro-4-methoxyphenyl)-N-[(pyridin-2-yl)methyl]carbamimidoyl}-4-fluorobenzamide |
| Molecular Weight: | 412.85 |
| Molecular Formula: | C21 H18 Cl F N4 O2 |
| Smiles: | COc1ccc(cc1[Cl])/N=C(\NCc1ccccn1)NC(c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5165 |
| logD: | 3.1788 |
| logSw: | -3.9878 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.025 |
| InChI Key: | NINXYAQIKSFOBO-UHFFFAOYSA-N |