methyl 4-({N'-(4-methoxyphenyl)-N-[(pyridin-2-yl)methyl]carbamimidoyl}carbamoyl)benzoate
Chemical Structure Depiction of
methyl 4-({N'-(4-methoxyphenyl)-N-[(pyridin-2-yl)methyl]carbamimidoyl}carbamoyl)benzoate
methyl 4-({N'-(4-methoxyphenyl)-N-[(pyridin-2-yl)methyl]carbamimidoyl}carbamoyl)benzoate
Compound characteristics
| Compound ID: | L086-0732 |
| Compound Name: | methyl 4-({N'-(4-methoxyphenyl)-N-[(pyridin-2-yl)methyl]carbamimidoyl}carbamoyl)benzoate |
| Molecular Weight: | 418.45 |
| Molecular Formula: | C23 H22 N4 O4 |
| Smiles: | COC(c1ccc(cc1)C(NC(/NCc1ccccn1)=N/c1ccc(cc1)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0054 |
| logD: | 2.0749 |
| logSw: | -3.4273 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.112 |
| InChI Key: | XLWQXCUULBYUCM-UHFFFAOYSA-N |