methyl 4-[N-(4-chlorobenzoyl)-N-(3-methoxypropyl)glycyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 4-[N-(4-chlorobenzoyl)-N-(3-methoxypropyl)glycyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
methyl 4-[N-(4-chlorobenzoyl)-N-(3-methoxypropyl)glycyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V025-1629 |
| Compound Name: | methyl 4-[N-(4-chlorobenzoyl)-N-(3-methoxypropyl)glycyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 420.89 |
| Molecular Formula: | C21 H25 Cl N2 O5 |
| Smiles: | Cc1c(C(CN(CCCOC)C(c2ccc(cc2)[Cl])=O)=O)c(C)[nH]c1C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.8187 |
| logD: | 2.8187 |
| logSw: | -3.8888 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.173 |
| InChI Key: | ORSNWDRBONUVEA-UHFFFAOYSA-N |