5-(4-hydroxyphenyl)-8,8-dimethyl-2-sulfanylidene-2,3,5,8,9,10-hexahydropyrimido[4,5-b]quinoline-4,6(1H,7H)-dione
Chemical Structure Depiction of
5-(4-hydroxyphenyl)-8,8-dimethyl-2-sulfanylidene-2,3,5,8,9,10-hexahydropyrimido[4,5-b]quinoline-4,6(1H,7H)-dione
5-(4-hydroxyphenyl)-8,8-dimethyl-2-sulfanylidene-2,3,5,8,9,10-hexahydropyrimido[4,5-b]quinoline-4,6(1H,7H)-dione
Compound characteristics
| Compound ID: | 4065-0104 |
| Compound Name: | 5-(4-hydroxyphenyl)-8,8-dimethyl-2-sulfanylidene-2,3,5,8,9,10-hexahydropyrimido[4,5-b]quinoline-4,6(1H,7H)-dione |
| Molecular Weight: | 369.44 |
| Molecular Formula: | C19 H19 N3 O3 S |
| Smiles: | CC1(C)CC2=C(C(C3=C(N2)NC(NC3=O)=S)c2ccc(cc2)O)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0203 |
| logD: | 1.8783 |
| logSw: | -2.5279 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 76.57 |
| InChI Key: | DNOHXBVKVYTRHS-CYBMUJFWSA-N |