3-[(4-methoxyphenyl)methyl]-2-{[2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl]sulfanyl}thieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-[(4-methoxyphenyl)methyl]-2-{[2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl]sulfanyl}thieno[3,2-d]pyrimidin-4(3H)-one
3-[(4-methoxyphenyl)methyl]-2-{[2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl]sulfanyl}thieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | E793-2327 |
| Compound Name: | 3-[(4-methoxyphenyl)methyl]-2-{[2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl]sulfanyl}thieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 493.6 |
| Molecular Formula: | C25 H23 N3 O4 S2 |
| Smiles: | Cc1ccc2c(c1)N(CCO2)C(CSC1=Nc2ccsc2C(N1Cc1ccc(cc1)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6169 |
| logD: | 4.6169 |
| logSw: | -4.4266 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.341 |
| InChI Key: | QHBWIHQFZHDBKJ-UHFFFAOYSA-N |