ethyl 3,5-dimethyl-4-[N-(3-methylbutanoyl)-N-(prop-2-en-1-yl)alanyl]-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 3,5-dimethyl-4-[N-(3-methylbutanoyl)-N-(prop-2-en-1-yl)alanyl]-1H-pyrrole-2-carboxylate
ethyl 3,5-dimethyl-4-[N-(3-methylbutanoyl)-N-(prop-2-en-1-yl)alanyl]-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V024-5585 |
| Compound Name: | ethyl 3,5-dimethyl-4-[N-(3-methylbutanoyl)-N-(prop-2-en-1-yl)alanyl]-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 362.47 |
| Molecular Formula: | C20 H30 N2 O4 |
| Smiles: | CCOC(c1c(C)c(C(C(C)N(CC=C)C(CC(C)C)=O)=O)c(C)[nH]1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3498 |
| logD: | 3.3498 |
| logSw: | -3.4619 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.01 |
| InChI Key: | DPELASDWBFTDGR-HNNXBMFYSA-N |