3-(3-methylphenyl)-4-(2-methylpropyl)-1-sulfanylidene-1H-[1,3]thiazolo[3,4-a]quinazolin-5(4H)-one
Chemical Structure Depiction of
3-(3-methylphenyl)-4-(2-methylpropyl)-1-sulfanylidene-1H-[1,3]thiazolo[3,4-a]quinazolin-5(4H)-one
3-(3-methylphenyl)-4-(2-methylpropyl)-1-sulfanylidene-1H-[1,3]thiazolo[3,4-a]quinazolin-5(4H)-one
Compound characteristics
| Compound ID: | C746-0647 |
| Compound Name: | 3-(3-methylphenyl)-4-(2-methylpropyl)-1-sulfanylidene-1H-[1,3]thiazolo[3,4-a]quinazolin-5(4H)-one |
| Molecular Weight: | 380.53 |
| Molecular Formula: | C21 H20 N2 O S2 |
| Smiles: | CC(C)CN1C2=C(c3cccc(C)c3)SC(N2c2ccccc2C1=O)=S |
| Stereo: | ACHIRAL |
| logP: | 5.5575 |
| logD: | 5.5575 |
| logSw: | -5.4694 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 18.0595 |
| InChI Key: | YWNSGUIYUDXMRY-UHFFFAOYSA-N |