5-{[(5-acetyl-2-methoxyphenyl)methyl]sulfanyl}-3-(2-methylphenyl)-6-phenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Chemical Structure Depiction of
5-{[(5-acetyl-2-methoxyphenyl)methyl]sulfanyl}-3-(2-methylphenyl)-6-phenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
5-{[(5-acetyl-2-methoxyphenyl)methyl]sulfanyl}-3-(2-methylphenyl)-6-phenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Compound characteristics
| Compound ID: | K286-4089 |
| Compound Name: | 5-{[(5-acetyl-2-methoxyphenyl)methyl]sulfanyl}-3-(2-methylphenyl)-6-phenyl-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one |
| Molecular Weight: | 545.7 |
| Molecular Formula: | C28 H23 N3 O3 S3 |
| Smiles: | CC(c1ccc(c(CSC2=NC3=C(C(N2c2ccccc2)=O)SC(N3c2ccccc2C)=S)c1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4966 |
| logD: | 5.4966 |
| logSw: | -5.4571 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 48.111 |
| InChI Key: | VSMLHXPJNVZIMN-UHFFFAOYSA-N |