ethyl 3,5-dimethyl-4-{N-[(oxolan-2-yl)methyl]-N-propanoylalanyl}-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 3,5-dimethyl-4-{N-[(oxolan-2-yl)methyl]-N-propanoylalanyl}-1H-pyrrole-2-carboxylate
ethyl 3,5-dimethyl-4-{N-[(oxolan-2-yl)methyl]-N-propanoylalanyl}-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V005-8437 |
| Compound Name: | ethyl 3,5-dimethyl-4-{N-[(oxolan-2-yl)methyl]-N-propanoylalanyl}-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 378.47 |
| Molecular Formula: | C20 H30 N2 O5 |
| Smiles: | CCC(N(CC1CCCO1)C(C)C(c1c(C)c(C(=O)OCC)[nH]c1C)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.1159 |
| logD: | 2.1159 |
| logSw: | -2.2078 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.414 |
| InChI Key: | VDBLBLYKWQHFQL-UHFFFAOYSA-N |