2-{[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl}-3-[(oxolan-2-yl)methyl]pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl}-3-[(oxolan-2-yl)methyl]pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
2-{[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl}-3-[(oxolan-2-yl)methyl]pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | F399-0562 |
| Compound Name: | 2-{[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl}-3-[(oxolan-2-yl)methyl]pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 465.59 |
| Molecular Formula: | C24 H23 N3 O3 S2 |
| Smiles: | Cc1ccc(C(CSC2=Nc3c4cccnc4sc3C(N2CC2CCCO2)=O)=O)c(C)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3414 |
| logD: | 4.3414 |
| logSw: | -4.3025 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.573 |
| InChI Key: | QPOFOLVOLABSER-MRXNPFEDSA-N |