ethyl 4-{N-(2-chlorobenzoyl)-N-[(pyridin-4-yl)methyl]glycyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-{N-(2-chlorobenzoyl)-N-[(pyridin-4-yl)methyl]glycyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
ethyl 4-{N-(2-chlorobenzoyl)-N-[(pyridin-4-yl)methyl]glycyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V005-5361 |
| Compound Name: | ethyl 4-{N-(2-chlorobenzoyl)-N-[(pyridin-4-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(Cc2ccncc2)C(c2ccccc2[Cl])=O)=O)c(C)[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7586 |
| logD: | 2.74 |
| logSw: | -3.789 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.588 |
| InChI Key: | GOQPLKBOWVBKIM-UHFFFAOYSA-N |