1-{4-[2-(2-methylpropyl)-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl}ethan-1-one
Chemical Structure Depiction of
1-{4-[2-(2-methylpropyl)-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl}ethan-1-one
1-{4-[2-(2-methylpropyl)-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | V029-6303 |
| Compound Name: | 1-{4-[2-(2-methylpropyl)-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl]piperazin-1-yl}ethan-1-one |
| Molecular Weight: | 386.56 |
| Molecular Formula: | C21 H30 N4 O S |
| Salt: | not_available |
| Smiles: | CC(C)Cc1nc(c2c3CCCCCc3sc2n1)N1CCN(CC1)C(C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2181 |
| logD: | 4.6349 |
| logSw: | -4.9389 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 41.737 |
| InChI Key: | ISYIAIWIBYWQJG-UHFFFAOYSA-N |