3-methyl-2-{[2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl]sulfanyl}-7-phenylthieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-methyl-2-{[2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl]sulfanyl}-7-phenylthieno[3,2-d]pyrimidin-4(3H)-one
3-methyl-2-{[2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl]sulfanyl}-7-phenylthieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | F847-0082 |
| Compound Name: | 3-methyl-2-{[2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl]sulfanyl}-7-phenylthieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 463.58 |
| Molecular Formula: | C24 H21 N3 O3 S2 |
| Smiles: | Cc1ccc2c(c1)N(CCO2)C(CSC1=Nc2c(csc2C(N1C)=O)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4476 |
| logD: | 4.4476 |
| logSw: | -4.3843 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.311 |
| InChI Key: | GIMNVPBFAYVBTH-UHFFFAOYSA-N |