1-{4-[3-bromo-4-(3-methylbut-2-en-1-yl)-4H-thieno[3,2-b]pyrrole-5-carbonyl]piperazin-1-yl}ethan-1-one
Chemical Structure Depiction of
1-{4-[3-bromo-4-(3-methylbut-2-en-1-yl)-4H-thieno[3,2-b]pyrrole-5-carbonyl]piperazin-1-yl}ethan-1-one
1-{4-[3-bromo-4-(3-methylbut-2-en-1-yl)-4H-thieno[3,2-b]pyrrole-5-carbonyl]piperazin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | V029-6220 |
| Compound Name: | 1-{4-[3-bromo-4-(3-methylbut-2-en-1-yl)-4H-thieno[3,2-b]pyrrole-5-carbonyl]piperazin-1-yl}ethan-1-one |
| Molecular Weight: | 424.36 |
| Molecular Formula: | C18 H22 Br N3 O2 S |
| Salt: | not_available |
| Smiles: | CC(C)=CCn1c(cc2c1c(cs2)[Br])C(N1CCN(CC1)C(C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5557 |
| logD: | 3.5557 |
| logSw: | -3.6279 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 35.581 |
| InChI Key: | VKBZXOQNVCHXGB-UHFFFAOYSA-N |