ethyl 4-{N-(4-chlorobenzoyl)-N-[(pyridin-2-yl)methyl]glycyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-{N-(4-chlorobenzoyl)-N-[(pyridin-2-yl)methyl]glycyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
ethyl 4-{N-(4-chlorobenzoyl)-N-[(pyridin-2-yl)methyl]glycyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V005-1946 |
| Compound Name: | ethyl 4-{N-(4-chlorobenzoyl)-N-[(pyridin-2-yl)methyl]glycyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 453.92 |
| Molecular Formula: | C24 H24 Cl N3 O4 |
| Salt: | not_available |
| Smiles: | CCOC(c1c(C)c(C(CN(Cc2ccccn2)C(c2ccc(cc2)[Cl])=O)=O)c(C)[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2732 |
| logD: | 3.2732 |
| logSw: | -4.0613 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.703 |
| InChI Key: | UKPBSFXWWIMPCP-UHFFFAOYSA-N |