3-acetamido-N-{N'-(4-bromophenyl)-N-[(oxolan-2-yl)methyl]carbamimidoyl}benzamide
Chemical Structure Depiction of
3-acetamido-N-{N'-(4-bromophenyl)-N-[(oxolan-2-yl)methyl]carbamimidoyl}benzamide
3-acetamido-N-{N'-(4-bromophenyl)-N-[(oxolan-2-yl)methyl]carbamimidoyl}benzamide
Compound characteristics
| Compound ID: | L088-0250 |
| Compound Name: | 3-acetamido-N-{N'-(4-bromophenyl)-N-[(oxolan-2-yl)methyl]carbamimidoyl}benzamide |
| Molecular Weight: | 459.34 |
| Molecular Formula: | C21 H23 Br N4 O3 |
| Smiles: | CC(Nc1cccc(c1)C(NC(/NCC1CCCO1)=N/c1ccc(cc1)[Br])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0482 |
| logD: | 3.0417 |
| logSw: | -3.3007 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 73.768 |
| InChI Key: | BVCMOLCBFVALLU-LJQANCHMSA-N |