3-acetamido-N-{N'-(3-bromophenyl)-N-[(pyridin-3-yl)methyl]carbamimidoyl}-4-methylbenzamide
Chemical Structure Depiction of
3-acetamido-N-{N'-(3-bromophenyl)-N-[(pyridin-3-yl)methyl]carbamimidoyl}-4-methylbenzamide
3-acetamido-N-{N'-(3-bromophenyl)-N-[(pyridin-3-yl)methyl]carbamimidoyl}-4-methylbenzamide
Compound characteristics
| Compound ID: | L087-1406 |
| Compound Name: | 3-acetamido-N-{N'-(3-bromophenyl)-N-[(pyridin-3-yl)methyl]carbamimidoyl}-4-methylbenzamide |
| Molecular Weight: | 480.36 |
| Molecular Formula: | C23 H22 Br N5 O2 |
| Smiles: | CC(Nc1cc(ccc1C)C(NC(/NCc1cccnc1)=N/c1cccc(c1)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7288 |
| logD: | 2.6924 |
| logSw: | -2.7635 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 73.933 |
| InChI Key: | RKHWZPXUKNERSN-UHFFFAOYSA-N |