3-bromo-N-{N'-(3,5-dimethylphenyl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl}benzamide
Chemical Structure Depiction of
3-bromo-N-{N'-(3,5-dimethylphenyl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl}benzamide
3-bromo-N-{N'-(3,5-dimethylphenyl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl}benzamide
Compound characteristics
| Compound ID: | F036-0779 |
| Compound Name: | 3-bromo-N-{N'-(3,5-dimethylphenyl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl}benzamide |
| Molecular Weight: | 489.41 |
| Molecular Formula: | C26 H25 Br N4 O |
| Smiles: | Cc1cc(C)cc(c1)/N=C(\NCCc1c[nH]c2ccccc12)NC(c1cccc(c1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 6.3303 |
| logD: | 5.6696 |
| logSw: | -5.7352 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 51.564 |
| InChI Key: | XNRPQHIIDMGDPA-UHFFFAOYSA-N |