N-{N'-(3-bromophenyl)-N-[(pyridin-4-yl)methyl]carbamimidoyl}-3,5-dimethoxybenzamide
Chemical Structure Depiction of
N-{N'-(3-bromophenyl)-N-[(pyridin-4-yl)methyl]carbamimidoyl}-3,5-dimethoxybenzamide
N-{N'-(3-bromophenyl)-N-[(pyridin-4-yl)methyl]carbamimidoyl}-3,5-dimethoxybenzamide
Compound characteristics
| Compound ID: | F430-4184 |
| Compound Name: | N-{N'-(3-bromophenyl)-N-[(pyridin-4-yl)methyl]carbamimidoyl}-3,5-dimethoxybenzamide |
| Molecular Weight: | 469.34 |
| Molecular Formula: | C22 H21 Br N4 O3 |
| Smiles: | COc1cc(cc(c1)OC)C(NC(/NCc1ccncc1)=N/c1cccc(c1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.7245 |
| logD: | 3.6326 |
| logSw: | -3.915 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.367 |
| InChI Key: | LACSZOIZOHZZFW-UHFFFAOYSA-N |