(4-bromophenyl){4-[2-(2-methylpropyl)-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl}methanone
Chemical Structure Depiction of
(4-bromophenyl){4-[2-(2-methylpropyl)-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl}methanone
(4-bromophenyl){4-[2-(2-methylpropyl)-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl}methanone
Compound characteristics
| Compound ID: | V002-5885 |
| Compound Name: | (4-bromophenyl){4-[2-(2-methylpropyl)-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl}methanone |
| Molecular Weight: | 527.53 |
| Molecular Formula: | C26 H31 Br N4 O S |
| Salt: | not_available |
| Smiles: | CC(C)Cc1nc(c2c3CCCCCc3sc2n1)N1CCN(CC1)C(c1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 7.2011 |
| logD: | 6.6178 |
| logSw: | -5.7505 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 40.998 |
| InChI Key: | HTJQTNFUDWCERG-UHFFFAOYSA-N |