4-chloro-N-{N'-(3,4-dimethoxyphenyl)-N-[(oxolan-2-yl)methyl]carbamimidoyl}benzamide
Chemical Structure Depiction of
4-chloro-N-{N'-(3,4-dimethoxyphenyl)-N-[(oxolan-2-yl)methyl]carbamimidoyl}benzamide
4-chloro-N-{N'-(3,4-dimethoxyphenyl)-N-[(oxolan-2-yl)methyl]carbamimidoyl}benzamide
Compound characteristics
| Compound ID: | L088-1283 |
| Compound Name: | 4-chloro-N-{N'-(3,4-dimethoxyphenyl)-N-[(oxolan-2-yl)methyl]carbamimidoyl}benzamide |
| Molecular Weight: | 417.89 |
| Molecular Formula: | C21 H24 Cl N3 O4 |
| Smiles: | COc1ccc(cc1OC)/N=C(\NCC1CCCO1)NC(c1ccc(cc1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1445 |
| logD: | 3.0798 |
| logSw: | -3.7139 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.767 |
| InChI Key: | AYFLBPDIGBIYRB-QGZVFWFLSA-N |