1-{4-[2-bromo-4-(2-phenylethyl)-4H-thieno[3,2-b]pyrrole-5-carbonyl]piperazin-1-yl}ethan-1-one
Chemical Structure Depiction of
1-{4-[2-bromo-4-(2-phenylethyl)-4H-thieno[3,2-b]pyrrole-5-carbonyl]piperazin-1-yl}ethan-1-one
1-{4-[2-bromo-4-(2-phenylethyl)-4H-thieno[3,2-b]pyrrole-5-carbonyl]piperazin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | V029-0762 |
| Compound Name: | 1-{4-[2-bromo-4-(2-phenylethyl)-4H-thieno[3,2-b]pyrrole-5-carbonyl]piperazin-1-yl}ethan-1-one |
| Molecular Weight: | 460.39 |
| Molecular Formula: | C21 H22 Br N3 O2 S |
| Smiles: | CC(N1CCN(CC1)C(c1cc2c(cc(s2)[Br])n1CCc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7844 |
| logD: | 3.7844 |
| logSw: | -3.9253 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 35.533 |
| InChI Key: | WNVDFBNFGWTBIP-UHFFFAOYSA-N |