4-chloro-N-{N'-(4-ethoxyphenyl)-N-[(pyridin-3-yl)methyl]carbamimidoyl}benzamide
Chemical Structure Depiction of
4-chloro-N-{N'-(4-ethoxyphenyl)-N-[(pyridin-3-yl)methyl]carbamimidoyl}benzamide
4-chloro-N-{N'-(4-ethoxyphenyl)-N-[(pyridin-3-yl)methyl]carbamimidoyl}benzamide
Compound characteristics
| Compound ID: | L087-0039 |
| Compound Name: | 4-chloro-N-{N'-(4-ethoxyphenyl)-N-[(pyridin-3-yl)methyl]carbamimidoyl}benzamide |
| Molecular Weight: | 408.89 |
| Molecular Formula: | C22 H21 Cl N4 O2 |
| Smiles: | CCOc1ccc(cc1)/N=C(\NCc1cccnc1)NC(c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.5781 |
| logD: | 3.1914 |
| logSw: | -3.9479 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.493 |
| InChI Key: | DENJMDCXIQEACJ-UHFFFAOYSA-N |