3-acetamido-N-{N'-(5-chloro-2-methylphenyl)-N-[(oxolan-2-yl)methyl]carbamimidoyl}-4-methylbenzamide
Chemical Structure Depiction of
3-acetamido-N-{N'-(5-chloro-2-methylphenyl)-N-[(oxolan-2-yl)methyl]carbamimidoyl}-4-methylbenzamide
3-acetamido-N-{N'-(5-chloro-2-methylphenyl)-N-[(oxolan-2-yl)methyl]carbamimidoyl}-4-methylbenzamide
Compound characteristics
| Compound ID: | L088-0137 |
| Compound Name: | 3-acetamido-N-{N'-(5-chloro-2-methylphenyl)-N-[(oxolan-2-yl)methyl]carbamimidoyl}-4-methylbenzamide |
| Molecular Weight: | 442.94 |
| Molecular Formula: | C23 H27 Cl N4 O3 |
| Smiles: | CC(Nc1cc(ccc1C)C(NC(/NCC1CCCO1)=N/c1cc(ccc1C)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.974 |
| logD: | 2.9606 |
| logSw: | -3.5885 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 72.372 |
| InChI Key: | CPUIXSKMZZUCGL-LJQANCHMSA-N |