1-[4-(2-cyclohexyl-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-2-(4-methoxyphenyl)ethan-1-one
Chemical Structure Depiction of
1-[4-(2-cyclohexyl-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-2-(4-methoxyphenyl)ethan-1-one
1-[4-(2-cyclohexyl-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-2-(4-methoxyphenyl)ethan-1-one
Compound characteristics
| Compound ID: | V009-9925 |
| Compound Name: | 1-[4-(2-cyclohexyl-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-2-(4-methoxyphenyl)ethan-1-one |
| Molecular Weight: | 518.72 |
| Molecular Formula: | C30 H38 N4 O2 S |
| Salt: | not_available |
| Smiles: | COc1ccc(CC(N2CCN(CC2)c2c3c4CCCCCc4sc3nc(C3CCCCC3)n2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 7.2842 |
| logD: | 6.6176 |
| logSw: | -5.7367 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 46.944 |
| InChI Key: | PGJYZPHCVAEUCH-UHFFFAOYSA-N |