ethyl 5-({cyclohexyl[(phenylsulfanyl)acetyl]amino}methyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-({cyclohexyl[(phenylsulfanyl)acetyl]amino}methyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate
ethyl 5-({cyclohexyl[(phenylsulfanyl)acetyl]amino}methyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | F347-0361 |
| Compound Name: | ethyl 5-({cyclohexyl[(phenylsulfanyl)acetyl]amino}methyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 428.59 |
| Molecular Formula: | C24 H32 N2 O3 S |
| Smiles: | CCOC(c1c(C)c(CN(C2CCCCC2)C(CSc2ccccc2)=O)[nH]c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9557 |
| logD: | 4.9557 |
| logSw: | -4.5308 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.126 |
| InChI Key: | OOTMKDPSPDLANW-UHFFFAOYSA-N |