methyl 4-{N-(4-chlorobenzoyl)-N-[(pyridin-2-yl)methyl]glycyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 4-{N-(4-chlorobenzoyl)-N-[(pyridin-2-yl)methyl]glycyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
methyl 4-{N-(4-chlorobenzoyl)-N-[(pyridin-2-yl)methyl]glycyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V006-9625 |
| Compound Name: | methyl 4-{N-(4-chlorobenzoyl)-N-[(pyridin-2-yl)methyl]glycyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 439.9 |
| Molecular Formula: | C23 H22 Cl N3 O4 |
| Salt: | not_available |
| Smiles: | Cc1c(C(CN(Cc2ccccn2)C(c2ccc(cc2)[Cl])=O)=O)c(C)[nH]c1C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.9146 |
| logD: | 2.9146 |
| logSw: | -3.8183 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.123 |
| InChI Key: | WJEQNQMRAKVPTH-UHFFFAOYSA-N |