2-bromo-N-{N-[2-(1H-indol-3-yl)ethyl]-N'-(2-methylphenyl)carbamimidoyl}benzamide
Chemical Structure Depiction of
2-bromo-N-{N-[2-(1H-indol-3-yl)ethyl]-N'-(2-methylphenyl)carbamimidoyl}benzamide
2-bromo-N-{N-[2-(1H-indol-3-yl)ethyl]-N'-(2-methylphenyl)carbamimidoyl}benzamide
Compound characteristics
Compound ID: | F036-0063 |
Compound Name: | 2-bromo-N-{N-[2-(1H-indol-3-yl)ethyl]-N'-(2-methylphenyl)carbamimidoyl}benzamide |
Molecular Weight: | 475.39 |
Molecular Formula: | C25 H23 Br N4 O |
Smiles: | Cc1ccccc1/N=C(\NCCc1c[nH]c2ccccc12)NC(c1ccccc1[Br])=O |
Stereo: | ACHIRAL |
logP: | 5.1785 |
logD: | 5.05 |
logSw: | -5.1551 |
Hydrogen bond acceptors count: | 3 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 50.866 |
InChI Key: | RKUULKOHTKLZKF-UHFFFAOYSA-N |