methyl 1-ethyl-3,5-dimethyl-4-{N-(2-methylpropanoyl)-N-[(pyridin-4-yl)methyl]glycyl}-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 1-ethyl-3,5-dimethyl-4-{N-(2-methylpropanoyl)-N-[(pyridin-4-yl)methyl]glycyl}-1H-pyrrole-2-carboxylate
methyl 1-ethyl-3,5-dimethyl-4-{N-(2-methylpropanoyl)-N-[(pyridin-4-yl)methyl]glycyl}-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V031-0664 |
| Compound Name: | methyl 1-ethyl-3,5-dimethyl-4-{N-(2-methylpropanoyl)-N-[(pyridin-4-yl)methyl]glycyl}-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 399.49 |
| Molecular Formula: | C22 H29 N3 O4 |
| Salt: | not_available |
| Smiles: | CCn1c(C)c(C(CN(Cc2ccncc2)C(C(C)C)=O)=O)c(C)c1C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.0615 |
| logD: | 2.0429 |
| logSw: | -2.1263 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.022 |
| InChI Key: | JLZZZUGYRDKNSX-UHFFFAOYSA-N |