N-{2-[({1-[(4-bromophenyl)methyl]-1H-pyrrol-2-yl}methyl)(cyclohexyl)amino]-2-oxoethyl}-N-(butan-2-yl)-4-ethylbenzamide
Chemical Structure Depiction of
N-{2-[({1-[(4-bromophenyl)methyl]-1H-pyrrol-2-yl}methyl)(cyclohexyl)amino]-2-oxoethyl}-N-(butan-2-yl)-4-ethylbenzamide
N-{2-[({1-[(4-bromophenyl)methyl]-1H-pyrrol-2-yl}methyl)(cyclohexyl)amino]-2-oxoethyl}-N-(butan-2-yl)-4-ethylbenzamide
Compound characteristics
| Compound ID: | V004-8071 |
| Compound Name: | N-{2-[({1-[(4-bromophenyl)methyl]-1H-pyrrol-2-yl}methyl)(cyclohexyl)amino]-2-oxoethyl}-N-(butan-2-yl)-4-ethylbenzamide |
| Molecular Weight: | 592.62 |
| Molecular Formula: | C33 H42 Br N3 O2 |
| Smiles: | CCC(C)N(CC(N(Cc1cccn1Cc1ccc(cc1)[Br])C1CCCCC1)=O)C(c1ccc(CC)cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.9632 |
| logD: | 7.9632 |
| logSw: | -5.6502 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.776 |
| InChI Key: | ZRGPKAVVBFBEKT-VWLOTQADSA-N |