N-{2-[({1-[(4-bromophenyl)methyl]-1H-pyrrol-2-yl}methyl)(cyclohexyl)amino]-2-oxoethyl}-4-methoxy-N-(3-methylbutyl)benzamide
Chemical Structure Depiction of
N-{2-[({1-[(4-bromophenyl)methyl]-1H-pyrrol-2-yl}methyl)(cyclohexyl)amino]-2-oxoethyl}-4-methoxy-N-(3-methylbutyl)benzamide
N-{2-[({1-[(4-bromophenyl)methyl]-1H-pyrrol-2-yl}methyl)(cyclohexyl)amino]-2-oxoethyl}-4-methoxy-N-(3-methylbutyl)benzamide
Compound characteristics
| Compound ID: | V011-4693 |
| Compound Name: | N-{2-[({1-[(4-bromophenyl)methyl]-1H-pyrrol-2-yl}methyl)(cyclohexyl)amino]-2-oxoethyl}-4-methoxy-N-(3-methylbutyl)benzamide |
| Molecular Weight: | 608.62 |
| Molecular Formula: | C33 H42 Br N3 O3 |
| Smiles: | CC(C)CCN(CC(N(Cc1cccn1Cc1ccc(cc1)[Br])C1CCCCC1)=O)C(c1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 7.16 |
| logD: | 7.16 |
| logSw: | -5.5861 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.97 |
| InChI Key: | SBBLHCCWHDTHCB-UHFFFAOYSA-N |