7,8-dimethoxy-2-{[(oxolan-2-yl)methyl]amino}-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
Chemical Structure Depiction of
7,8-dimethoxy-2-{[(oxolan-2-yl)methyl]amino}-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
7,8-dimethoxy-2-{[(oxolan-2-yl)methyl]amino}-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
Compound characteristics
Compound ID: | F127-0317 |
Compound Name: | 7,8-dimethoxy-2-{[(oxolan-2-yl)methyl]amino}-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one |
Molecular Weight: | 362.41 |
Molecular Formula: | C16 H18 N4 O4 S |
Smiles: | COc1cc2C(N3C(=Nc2cc1OC)SC(NCC1CCCO1)=N3)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 1.4502 |
logD: | 1.4493 |
logSw: | -2.2891 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 72.104 |
InChI Key: | MLHLBCZTPXRIDC-SECBINFHSA-N |