3-(3-chlorophenyl)-1-sulfanylidene-4-{[3-(trifluoromethyl)phenyl]methyl}-1H-[1,3]thiazolo[3,4-a]quinazolin-5(4H)-one
Chemical Structure Depiction of
3-(3-chlorophenyl)-1-sulfanylidene-4-{[3-(trifluoromethyl)phenyl]methyl}-1H-[1,3]thiazolo[3,4-a]quinazolin-5(4H)-one
3-(3-chlorophenyl)-1-sulfanylidene-4-{[3-(trifluoromethyl)phenyl]methyl}-1H-[1,3]thiazolo[3,4-a]quinazolin-5(4H)-one
Compound characteristics
| Compound ID: | K233-0930 |
| Compound Name: | 3-(3-chlorophenyl)-1-sulfanylidene-4-{[3-(trifluoromethyl)phenyl]methyl}-1H-[1,3]thiazolo[3,4-a]quinazolin-5(4H)-one |
| Molecular Weight: | 502.96 |
| Molecular Formula: | C24 H14 Cl F3 N2 O S2 |
| Smiles: | C(c1cccc(c1)C(F)(F)F)N1C2=C(c3cccc(c3)[Cl])SC(N2c2ccccc2C1=O)=S |
| Stereo: | ACHIRAL |
| logP: | 6.9667 |
| logD: | 6.9667 |
| logSw: | -6.5436 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 17.788 |
| InChI Key: | OPBPVVMRGNRPAY-UHFFFAOYSA-N |