5-{4-[(2,4-dichlorophenyl)methoxy]-3-methoxyphenyl}-3-phenyl-2-sulfanylidene-2,3,5,6-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-7(4H)-one
Chemical Structure Depiction of
5-{4-[(2,4-dichlorophenyl)methoxy]-3-methoxyphenyl}-3-phenyl-2-sulfanylidene-2,3,5,6-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-7(4H)-one
5-{4-[(2,4-dichlorophenyl)methoxy]-3-methoxyphenyl}-3-phenyl-2-sulfanylidene-2,3,5,6-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | 8008-5496 |
| Compound Name: | 5-{4-[(2,4-dichlorophenyl)methoxy]-3-methoxyphenyl}-3-phenyl-2-sulfanylidene-2,3,5,6-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-7(4H)-one |
| Molecular Weight: | 544.48 |
| Molecular Formula: | C25 H19 Cl2 N3 O3 S2 |
| Smiles: | COc1cc(ccc1OCc1ccc(cc1[Cl])[Cl])C1NC2=C(C(N1)=O)SC(N2c1ccccc1)=S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3878 |
| logD: | 5.3878 |
| logSw: | -6.0615 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.117 |
| InChI Key: | OTDGJLLYFUTUBZ-QFIPXVFZSA-N |