5-(2,5-dimethoxyphenyl)-3-phenyl-2-sulfanylidene-2,3,5,6-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-7(4H)-one
Chemical Structure Depiction of
5-(2,5-dimethoxyphenyl)-3-phenyl-2-sulfanylidene-2,3,5,6-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-7(4H)-one
5-(2,5-dimethoxyphenyl)-3-phenyl-2-sulfanylidene-2,3,5,6-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-7(4H)-one
Compound characteristics
Compound ID: | 8008-4506 |
Compound Name: | 5-(2,5-dimethoxyphenyl)-3-phenyl-2-sulfanylidene-2,3,5,6-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-7(4H)-one |
Molecular Weight: | 399.49 |
Molecular Formula: | C19 H17 N3 O3 S2 |
Smiles: | COc1ccc(c(c1)C1NC2=C(C(N1)=O)SC(N2c1ccccc1)=S)OC |
Stereo: | RACEMIC MIXTURE |
logP: | 3.0902 |
logD: | 3.0902 |
logSw: | -3.5382 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 53.346 |
InChI Key: | ZCADHEMQUCMJDQ-MRXNPFEDSA-N |