4-[2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl]-6-(4-methylphenyl)-2-(methylsulfanyl)[1,3]thiazolo[4,5-d]pyrimidine-5,7(4H,6H)-dione
Chemical Structure Depiction of
4-[2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl]-6-(4-methylphenyl)-2-(methylsulfanyl)[1,3]thiazolo[4,5-d]pyrimidine-5,7(4H,6H)-dione
4-[2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl]-6-(4-methylphenyl)-2-(methylsulfanyl)[1,3]thiazolo[4,5-d]pyrimidine-5,7(4H,6H)-dione
Compound characteristics
| Compound ID: | L863-0239 |
| Compound Name: | 4-[2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl]-6-(4-methylphenyl)-2-(methylsulfanyl)[1,3]thiazolo[4,5-d]pyrimidine-5,7(4H,6H)-dione |
| Molecular Weight: | 494.59 |
| Molecular Formula: | C24 H22 N4 O4 S2 |
| Smiles: | Cc1ccc(cc1)N1C(c2c(nc(SC)s2)N(CC(N2CCOc3ccc(C)cc23)=O)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2506 |
| logD: | 4.2506 |
| logSw: | -4.2909 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 64.313 |
| InChI Key: | KTOUPBYTDCCAKB-UHFFFAOYSA-N |