methyl 4-[N-(4-chlorobenzoyl)-N-(3-methylbutyl)glycyl]-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 4-[N-(4-chlorobenzoyl)-N-(3-methylbutyl)glycyl]-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
methyl 4-[N-(4-chlorobenzoyl)-N-(3-methylbutyl)glycyl]-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V005-6690 |
| Compound Name: | methyl 4-[N-(4-chlorobenzoyl)-N-(3-methylbutyl)glycyl]-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 446.97 |
| Molecular Formula: | C24 H31 Cl N2 O4 |
| Smiles: | CCn1c(C)c(C(CN(CCC(C)C)C(c2ccc(cc2)[Cl])=O)=O)c(C)c1C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 4.6359 |
| logD: | 4.6359 |
| logSw: | -5.0245 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.572 |
| InChI Key: | OOKSLNDOMMQGDM-UHFFFAOYSA-N |