N-{2-[({1-[(2-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)(cyclohexyl)amino]-2-oxoethyl}-N-ethyl-4-nitrobenzamide
Chemical Structure Depiction of
N-{2-[({1-[(2-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)(cyclohexyl)amino]-2-oxoethyl}-N-ethyl-4-nitrobenzamide
N-{2-[({1-[(2-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)(cyclohexyl)amino]-2-oxoethyl}-N-ethyl-4-nitrobenzamide
Compound characteristics
| Compound ID: | V018-0759 |
| Compound Name: | N-{2-[({1-[(2-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)(cyclohexyl)amino]-2-oxoethyl}-N-ethyl-4-nitrobenzamide |
| Molecular Weight: | 537.06 |
| Molecular Formula: | C29 H33 Cl N4 O4 |
| Smiles: | CCN(CC(N(Cc1cccn1Cc1ccccc1[Cl])C1CCCCC1)=O)C(c1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6287 |
| logD: | 5.6287 |
| logSw: | -5.9157 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 66.554 |
| InChI Key: | PRNUDEABMFTHNE-UHFFFAOYSA-N |