methyl 4-{N-[(furan-2-yl)methyl]-N-(3-methylbutanoyl)alanyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 4-{N-[(furan-2-yl)methyl]-N-(3-methylbutanoyl)alanyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
methyl 4-{N-[(furan-2-yl)methyl]-N-(3-methylbutanoyl)alanyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V025-1036 |
| Compound Name: | methyl 4-{N-[(furan-2-yl)methyl]-N-(3-methylbutanoyl)alanyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 388.46 |
| Molecular Formula: | C21 H28 N2 O5 |
| Smiles: | CC(C)CC(N(Cc1ccco1)C(C)C(c1c(C)c(C(=O)OC)[nH]c1C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3598 |
| logD: | 3.3598 |
| logSw: | -3.5181 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.929 |
| InChI Key: | PBQQILSDXUEZQC-HNNXBMFYSA-N |