2-(diethylamino)-5-{[2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl]sulfanyl}-6-(propan-2-yl)[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Chemical Structure Depiction of
2-(diethylamino)-5-{[2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl]sulfanyl}-6-(propan-2-yl)[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
2-(diethylamino)-5-{[2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl]sulfanyl}-6-(propan-2-yl)[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Compound characteristics
| Compound ID: | L387-1499 |
| Compound Name: | 2-(diethylamino)-5-{[2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl]sulfanyl}-6-(propan-2-yl)[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one |
| Molecular Weight: | 487.64 |
| Molecular Formula: | C23 H29 N5 O3 S2 |
| Smiles: | CCN(CC)c1nc2c(C(N(C(C)C)C(=N2)SCC(N2CCOc3ccc(C)cc23)=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.5648 |
| logD: | 4.5648 |
| logSw: | -4.4513 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.904 |
| InChI Key: | IXYBSNUZYBUAMX-UHFFFAOYSA-N |