methyl 4-[N-cyclohexyl-N-(3-fluorobenzoyl)glycyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 4-[N-cyclohexyl-N-(3-fluorobenzoyl)glycyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
methyl 4-[N-cyclohexyl-N-(3-fluorobenzoyl)glycyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V025-7596 |
| Compound Name: | methyl 4-[N-cyclohexyl-N-(3-fluorobenzoyl)glycyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 414.48 |
| Molecular Formula: | C23 H27 F N2 O4 |
| Smiles: | Cc1c(C(CN(C2CCCCC2)C(c2cccc(c2)F)=O)=O)c(C)[nH]c1C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 4.0789 |
| logD: | 4.0789 |
| logSw: | -4.3488 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.825 |
| InChI Key: | ZHSWNKVMDZJGPV-UHFFFAOYSA-N |