4-bromo-N-{N'-(3,5-dimethoxyphenyl)-N-[(pyridin-4-yl)methyl]carbamimidoyl}benzamide
Chemical Structure Depiction of
4-bromo-N-{N'-(3,5-dimethoxyphenyl)-N-[(pyridin-4-yl)methyl]carbamimidoyl}benzamide
4-bromo-N-{N'-(3,5-dimethoxyphenyl)-N-[(pyridin-4-yl)methyl]carbamimidoyl}benzamide
Compound characteristics
| Compound ID: | F430-4064 |
| Compound Name: | 4-bromo-N-{N'-(3,5-dimethoxyphenyl)-N-[(pyridin-4-yl)methyl]carbamimidoyl}benzamide |
| Molecular Weight: | 469.34 |
| Molecular Formula: | C22 H21 Br N4 O3 |
| Smiles: | COc1cc(cc(c1)OC)/N=C(\NCc1ccncc1)NC(c1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.7362 |
| logD: | 3.56 |
| logSw: | -3.9477 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.367 |
| InChI Key: | UNNDZADCLIYAFZ-UHFFFAOYSA-N |