[4-(methanesulfonyl)piperazin-1-yl](4-methoxy-2-phenyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-7-yl)methanone
Chemical Structure Depiction of
[4-(methanesulfonyl)piperazin-1-yl](4-methoxy-2-phenyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-7-yl)methanone
[4-(methanesulfonyl)piperazin-1-yl](4-methoxy-2-phenyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-7-yl)methanone
Compound characteristics
| Compound ID: | SD54-0208 |
| Compound Name: | [4-(methanesulfonyl)piperazin-1-yl](4-methoxy-2-phenyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-7-yl)methanone |
| Molecular Weight: | 444.55 |
| Molecular Formula: | C22 H28 N4 O4 S |
| Smiles: | COc1c2CCC(CCc2nc(c2ccccc2)n1)C(N1CCN(CC1)S(C)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0379 |
| logD: | 3.0379 |
| logSw: | -3.2388 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 76.523 |
| InChI Key: | AGKDXUNLVMNDJE-KRWDZBQOSA-N |