2-butyl-4-[4-(ethanesulfonyl)piperazin-1-yl]-7-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
Chemical Structure Depiction of
2-butyl-4-[4-(ethanesulfonyl)piperazin-1-yl]-7-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
2-butyl-4-[4-(ethanesulfonyl)piperazin-1-yl]-7-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
Compound characteristics
| Compound ID: | V001-3110 |
| Compound Name: | 2-butyl-4-[4-(ethanesulfonyl)piperazin-1-yl]-7-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine |
| Molecular Weight: | 436.64 |
| Molecular Formula: | C21 H32 N4 O2 S2 |
| Salt: | not_available |
| Smiles: | CCCCc1nc(c2c3CCC(C)Cc3sc2n1)N1CCN(CC1)S(CC)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.298 |
| logD: | 4.8493 |
| logSw: | -5.2137 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.896 |
| InChI Key: | NGXWNECBEFWVTN-OAHLLOKOSA-N |