methyl 4-{N-(4-methoxybenzoyl)-N-[(oxolan-2-yl)methyl]alanyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 4-{N-(4-methoxybenzoyl)-N-[(oxolan-2-yl)methyl]alanyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
methyl 4-{N-(4-methoxybenzoyl)-N-[(oxolan-2-yl)methyl]alanyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V005-4317 |
| Compound Name: | methyl 4-{N-(4-methoxybenzoyl)-N-[(oxolan-2-yl)methyl]alanyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 442.51 |
| Molecular Formula: | C24 H30 N2 O6 |
| Smiles: | CC(C(c1c(C)c(C(=O)OC)[nH]c1C)=O)N(CC1CCCO1)C(c1ccc(cc1)OC)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.7018 |
| logD: | 2.7018 |
| logSw: | -2.9564 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.634 |
| InChI Key: | SQWSPVPTWVIXBU-UHFFFAOYSA-N |