3-acetamido-N-{N'-(3-bromophenyl)-N-[(oxolan-2-yl)methyl]carbamimidoyl}-4-methylbenzamide
Chemical Structure Depiction of
3-acetamido-N-{N'-(3-bromophenyl)-N-[(oxolan-2-yl)methyl]carbamimidoyl}-4-methylbenzamide
3-acetamido-N-{N'-(3-bromophenyl)-N-[(oxolan-2-yl)methyl]carbamimidoyl}-4-methylbenzamide
Compound characteristics
| Compound ID: | L088-1415 |
| Compound Name: | 3-acetamido-N-{N'-(3-bromophenyl)-N-[(oxolan-2-yl)methyl]carbamimidoyl}-4-methylbenzamide |
| Molecular Weight: | 473.37 |
| Molecular Formula: | C22 H25 Br N4 O3 |
| Smiles: | CC(Nc1cc(ccc1C)C(NC(/NCC1CCCO1)=N/c1cccc(c1)[Br])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8267 |
| logD: | 2.8182 |
| logSw: | -3.1835 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 73.07 |
| InChI Key: | WNBBABJRBGIYCQ-LJQANCHMSA-N |