4-[(2,5-dimethylphenyl)methyl]-3-(4-fluorophenyl)-1-sulfanylidene-1H-[1,3]thiazolo[3,4-a]quinazolin-5(4H)-one
Chemical Structure Depiction of
4-[(2,5-dimethylphenyl)methyl]-3-(4-fluorophenyl)-1-sulfanylidene-1H-[1,3]thiazolo[3,4-a]quinazolin-5(4H)-one
4-[(2,5-dimethylphenyl)methyl]-3-(4-fluorophenyl)-1-sulfanylidene-1H-[1,3]thiazolo[3,4-a]quinazolin-5(4H)-one
Compound characteristics
| Compound ID: | C746-0106 |
| Compound Name: | 4-[(2,5-dimethylphenyl)methyl]-3-(4-fluorophenyl)-1-sulfanylidene-1H-[1,3]thiazolo[3,4-a]quinazolin-5(4H)-one |
| Molecular Weight: | 446.56 |
| Molecular Formula: | C25 H19 F N2 O S2 |
| Smiles: | Cc1ccc(C)c(CN2C3=C(c4ccc(cc4)F)SC(N3c3ccccc3C2=O)=S)c1 |
| Stereo: | ACHIRAL |
| logP: | 6.6871 |
| logD: | 6.6871 |
| logSw: | -5.6004 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 17.788 |
| InChI Key: | PDDBYMQZBHFGJJ-UHFFFAOYSA-N |