N-{2-[({1-[(4-bromophenyl)methyl]-1H-pyrrol-2-yl}methyl)(butyl)amino]-2-oxoethyl}-N-butyl-3,5-dimethoxybenzamide
Chemical Structure Depiction of
N-{2-[({1-[(4-bromophenyl)methyl]-1H-pyrrol-2-yl}methyl)(butyl)amino]-2-oxoethyl}-N-butyl-3,5-dimethoxybenzamide
N-{2-[({1-[(4-bromophenyl)methyl]-1H-pyrrol-2-yl}methyl)(butyl)amino]-2-oxoethyl}-N-butyl-3,5-dimethoxybenzamide
Compound characteristics
| Compound ID: | V009-9564 |
| Compound Name: | N-{2-[({1-[(4-bromophenyl)methyl]-1H-pyrrol-2-yl}methyl)(butyl)amino]-2-oxoethyl}-N-butyl-3,5-dimethoxybenzamide |
| Molecular Weight: | 598.58 |
| Molecular Formula: | C31 H40 Br N3 O4 |
| Smiles: | CCCCN(Cc1cccn1Cc1ccc(cc1)[Br])C(CN(CCCC)C(c1cc(cc(c1)OC)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.5708 |
| logD: | 6.5708 |
| logSw: | -5.5487 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.519 |
| InChI Key: | DGEZUHPUZQHXSW-UHFFFAOYSA-N |