ethyl 1,3,5-trimethyl-4-{N-(4-methylbenzoyl)-N-[(pyridin-3-yl)methyl]glycyl}-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 1,3,5-trimethyl-4-{N-(4-methylbenzoyl)-N-[(pyridin-3-yl)methyl]glycyl}-1H-pyrrole-2-carboxylate
ethyl 1,3,5-trimethyl-4-{N-(4-methylbenzoyl)-N-[(pyridin-3-yl)methyl]glycyl}-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V017-5108 |
| Compound Name: | ethyl 1,3,5-trimethyl-4-{N-(4-methylbenzoyl)-N-[(pyridin-3-yl)methyl]glycyl}-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 447.53 |
| Molecular Formula: | C26 H29 N3 O4 |
| Salt: | not_available |
| Smiles: | CCOC(c1c(C)c(C(CN(Cc2cccnc2)C(c2ccc(C)cc2)=O)=O)c(C)n1C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6287 |
| logD: | 2.6287 |
| logSw: | -2.3021 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.505 |
| InChI Key: | FECDSBIYJZGFLM-UHFFFAOYSA-N |