N-{N'-(3-bromophenyl)-N-[(pyridin-2-yl)methyl]carbamimidoyl}-3,4,5-trimethoxybenzamide
Chemical Structure Depiction of
N-{N'-(3-bromophenyl)-N-[(pyridin-2-yl)methyl]carbamimidoyl}-3,4,5-trimethoxybenzamide
N-{N'-(3-bromophenyl)-N-[(pyridin-2-yl)methyl]carbamimidoyl}-3,4,5-trimethoxybenzamide
Compound characteristics
| Compound ID: | L086-1418 |
| Compound Name: | N-{N'-(3-bromophenyl)-N-[(pyridin-2-yl)methyl]carbamimidoyl}-3,4,5-trimethoxybenzamide |
| Molecular Weight: | 499.36 |
| Molecular Formula: | C23 H23 Br N4 O4 |
| Smiles: | COc1cc(cc(c1OC)OC)C(NC(/NCc1ccccn1)=N/c1cccc(c1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.6865 |
| logD: | 3.5268 |
| logSw: | -4.0245 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.372 |
| InChI Key: | ZQVIMZAXAOBXSI-UHFFFAOYSA-N |