methyl 3,5-dimethyl-4-{N-(2-methylpropanoyl)-N-[(pyridin-3-yl)methyl]alanyl}-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 3,5-dimethyl-4-{N-(2-methylpropanoyl)-N-[(pyridin-3-yl)methyl]alanyl}-1H-pyrrole-2-carboxylate
methyl 3,5-dimethyl-4-{N-(2-methylpropanoyl)-N-[(pyridin-3-yl)methyl]alanyl}-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V028-2384 |
| Compound Name: | methyl 3,5-dimethyl-4-{N-(2-methylpropanoyl)-N-[(pyridin-3-yl)methyl]alanyl}-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 385.46 |
| Molecular Formula: | C21 H27 N3 O4 |
| Smiles: | CC(C)C(N(Cc1cccnc1)C(C)C(c1c(C)c(C(=O)OC)[nH]c1C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.076 |
| logD: | 2.0758 |
| logSw: | -2.0267 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.225 |
| InChI Key: | NAKITAOODOGITC-HNNXBMFYSA-N |