ethyl 3,5-dimethyl-4-[N-(4-methylbenzoyl)-N-(3-methylbutyl)alanyl]-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 3,5-dimethyl-4-[N-(4-methylbenzoyl)-N-(3-methylbutyl)alanyl]-1H-pyrrole-2-carboxylate
ethyl 3,5-dimethyl-4-[N-(4-methylbenzoyl)-N-(3-methylbutyl)alanyl]-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V024-9025 |
| Compound Name: | ethyl 3,5-dimethyl-4-[N-(4-methylbenzoyl)-N-(3-methylbutyl)alanyl]-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 426.56 |
| Molecular Formula: | C25 H34 N2 O4 |
| Smiles: | CCOC(c1c(C)c(C(C(C)N(CCC(C)C)C(c2ccc(C)cc2)=O)=O)c(C)[nH]1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.055 |
| logD: | 5.055 |
| logSw: | -4.6752 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.265 |
| InChI Key: | CKAMKLUZAWQXMW-IBGZPJMESA-N |