3-acetamido-N-{N'-(3-chloro-4-fluorophenyl)-N-[(oxolan-2-yl)methyl]carbamimidoyl}-4-methylbenzamide
Chemical Structure Depiction of
3-acetamido-N-{N'-(3-chloro-4-fluorophenyl)-N-[(oxolan-2-yl)methyl]carbamimidoyl}-4-methylbenzamide
3-acetamido-N-{N'-(3-chloro-4-fluorophenyl)-N-[(oxolan-2-yl)methyl]carbamimidoyl}-4-methylbenzamide
Compound characteristics
| Compound ID: | L088-1042 |
| Compound Name: | 3-acetamido-N-{N'-(3-chloro-4-fluorophenyl)-N-[(oxolan-2-yl)methyl]carbamimidoyl}-4-methylbenzamide |
| Molecular Weight: | 446.91 |
| Molecular Formula: | C22 H24 Cl F N4 O3 |
| Smiles: | CC(Nc1cc(ccc1C)C(NC(/NCC1CCCO1)=N/c1ccc(c(c1)[Cl])F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6279 |
| logD: | 2.6233 |
| logSw: | -3.5577 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 73.07 |
| InChI Key: | HVCQGOBHLQABNV-QGZVFWFLSA-N |