ethyl 3,5-dimethyl-4-({[(4-methylphenyl)methyl][(phenylsulfanyl)acetyl]amino}methyl)-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 3,5-dimethyl-4-({[(4-methylphenyl)methyl][(phenylsulfanyl)acetyl]amino}methyl)-1H-pyrrole-2-carboxylate
ethyl 3,5-dimethyl-4-({[(4-methylphenyl)methyl][(phenylsulfanyl)acetyl]amino}methyl)-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | G798-0059 |
| Compound Name: | ethyl 3,5-dimethyl-4-({[(4-methylphenyl)methyl][(phenylsulfanyl)acetyl]amino}methyl)-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 450.6 |
| Molecular Formula: | C26 H30 N2 O3 S |
| Smiles: | CCOC(c1c(C)c(CN(Cc2ccc(C)cc2)C(CSc2ccccc2)=O)c(C)[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1718 |
| logD: | 5.1718 |
| logSw: | -4.9432 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.386 |
| InChI Key: | KHEDAUOXKOGANJ-UHFFFAOYSA-N |