methyl 3,5-dimethyl-4-{N-[(pyridin-4-yl)methyl]-N-(thiophene-2-carbonyl)glycyl}-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 3,5-dimethyl-4-{N-[(pyridin-4-yl)methyl]-N-(thiophene-2-carbonyl)glycyl}-1H-pyrrole-2-carboxylate
methyl 3,5-dimethyl-4-{N-[(pyridin-4-yl)methyl]-N-(thiophene-2-carbonyl)glycyl}-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V007-3681 |
| Compound Name: | methyl 3,5-dimethyl-4-{N-[(pyridin-4-yl)methyl]-N-(thiophene-2-carbonyl)glycyl}-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 411.48 |
| Molecular Formula: | C21 H21 N3 O4 S |
| Salt: | not_available |
| Smiles: | Cc1c(C(CN(Cc2ccncc2)C(c2cccs2)=O)=O)c(C)[nH]c1C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.1224 |
| logD: | 2.1038 |
| logSw: | -2.4533 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.027 |
| InChI Key: | QZURYESWSBROLU-UHFFFAOYSA-N |