methyl 4-[N-(3-ethoxypropyl)-N-(3-fluorobenzoyl)glycyl]-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 4-[N-(3-ethoxypropyl)-N-(3-fluorobenzoyl)glycyl]-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
methyl 4-[N-(3-ethoxypropyl)-N-(3-fluorobenzoyl)glycyl]-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V005-6641 |
| Compound Name: | methyl 4-[N-(3-ethoxypropyl)-N-(3-fluorobenzoyl)glycyl]-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 446.52 |
| Molecular Formula: | C24 H31 F N2 O5 |
| Smiles: | CCn1c(C)c(C(CN(CCCOCC)C(c2cccc(c2)F)=O)=O)c(C)c1C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.0102 |
| logD: | 3.0102 |
| logSw: | -3.1688 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.549 |
| InChI Key: | WBIUCLLDBUTSHN-UHFFFAOYSA-N |