methyl 4-{N-[(4-fluorophenyl)methyl]-N-(thiophene-2-carbonyl)glycyl}-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 4-{N-[(4-fluorophenyl)methyl]-N-(thiophene-2-carbonyl)glycyl}-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
methyl 4-{N-[(4-fluorophenyl)methyl]-N-(thiophene-2-carbonyl)glycyl}-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V004-8547 |
| Compound Name: | methyl 4-{N-[(4-fluorophenyl)methyl]-N-(thiophene-2-carbonyl)glycyl}-1,3,5-trimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 442.51 |
| Molecular Formula: | C23 H23 F N2 O4 S |
| Smiles: | Cc1c(C(CN(Cc2ccc(cc2)F)C(c2cccs2)=O)=O)c(C)n(C)c1C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.334 |
| logD: | 3.334 |
| logSw: | -3.6894 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.425 |
| InChI Key: | XTKZEPPCRKFOHS-UHFFFAOYSA-N |