methyl 3,5-dimethyl-4-{N-(4-methylbenzoyl)-N-[(pyridin-4-yl)methyl]glycyl}-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 3,5-dimethyl-4-{N-(4-methylbenzoyl)-N-[(pyridin-4-yl)methyl]glycyl}-1H-pyrrole-2-carboxylate
methyl 3,5-dimethyl-4-{N-(4-methylbenzoyl)-N-[(pyridin-4-yl)methyl]glycyl}-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V005-4362 |
| Compound Name: | methyl 3,5-dimethyl-4-{N-(4-methylbenzoyl)-N-[(pyridin-4-yl)methyl]glycyl}-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 419.48 |
| Molecular Formula: | C24 H25 N3 O4 |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)C(N(CC(c1c(C)c(C(=O)OC)[nH]c1C)=O)Cc1ccncc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4094 |
| logD: | 2.3908 |
| logSw: | -2.5246 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.008 |
| InChI Key: | DOAFSIOCZVZOIM-UHFFFAOYSA-N |