1-[4-(3-bromo-4-{[4-(trifluoromethyl)phenyl]methyl}-4H-thieno[3,2-b]pyrrole-5-carbonyl)piperazin-1-yl]ethan-1-one
Chemical Structure Depiction of
1-[4-(3-bromo-4-{[4-(trifluoromethyl)phenyl]methyl}-4H-thieno[3,2-b]pyrrole-5-carbonyl)piperazin-1-yl]ethan-1-one
1-[4-(3-bromo-4-{[4-(trifluoromethyl)phenyl]methyl}-4H-thieno[3,2-b]pyrrole-5-carbonyl)piperazin-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | V024-5021 |
| Compound Name: | 1-[4-(3-bromo-4-{[4-(trifluoromethyl)phenyl]methyl}-4H-thieno[3,2-b]pyrrole-5-carbonyl)piperazin-1-yl]ethan-1-one |
| Molecular Weight: | 514.36 |
| Molecular Formula: | C21 H19 Br F3 N3 O2 S |
| Smiles: | CC(N1CCN(CC1)C(c1cc2c(c(cs2)[Br])n1Cc1ccc(cc1)C(F)(F)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3084 |
| logD: | 4.3084 |
| logSw: | -4.2761 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 35.331 |
| InChI Key: | ZKHLBYWAGCEFDF-UHFFFAOYSA-N |