N-{N'-(3-bromophenyl)-N-[(pyridin-3-yl)methyl]carbamimidoyl}-4-methylbenzamide
Chemical Structure Depiction of
N-{N'-(3-bromophenyl)-N-[(pyridin-3-yl)methyl]carbamimidoyl}-4-methylbenzamide
N-{N'-(3-bromophenyl)-N-[(pyridin-3-yl)methyl]carbamimidoyl}-4-methylbenzamide
Compound characteristics
| Compound ID: | L087-1396 |
| Compound Name: | N-{N'-(3-bromophenyl)-N-[(pyridin-3-yl)methyl]carbamimidoyl}-4-methylbenzamide |
| Molecular Weight: | 423.31 |
| Molecular Formula: | C21 H19 Br N4 O |
| Smiles: | Cc1ccc(cc1)C(NC(/NCc1cccnc1)=N/c1cccc(c1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.0113 |
| logD: | 3.9749 |
| logSw: | -3.8116 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.369 |
| InChI Key: | JRBHCRARXCITIM-UHFFFAOYSA-N |