7-tert-butyl-2-{[(2-methyl-1,3-thiazol-4-yl)methyl]sulfanyl}-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
7-tert-butyl-2-{[(2-methyl-1,3-thiazol-4-yl)methyl]sulfanyl}-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
7-tert-butyl-2-{[(2-methyl-1,3-thiazol-4-yl)methyl]sulfanyl}-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 8015-7448 |
| Compound Name: | 7-tert-butyl-2-{[(2-methyl-1,3-thiazol-4-yl)methyl]sulfanyl}-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 481.7 |
| Molecular Formula: | C25 H27 N3 O S3 |
| Smiles: | Cc1nc(CSC2=Nc3c(C(N2c2ccccc2)=O)c2CCC(Cc2s3)C(C)(C)C)cs1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.651 |
| logD: | 6.651 |
| logSw: | -5.724 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 35.29 |
| InChI Key: | CWKKERYAOZEOIR-MRXNPFEDSA-N |