3-(4-chlorophenyl)-8-(4-phenylpiperazine-1-carbonyl)-1-sulfanylidene-1H-[1,3]thiazolo[3,4-a]quinazolin-5(4H)-one
Chemical Structure Depiction of
3-(4-chlorophenyl)-8-(4-phenylpiperazine-1-carbonyl)-1-sulfanylidene-1H-[1,3]thiazolo[3,4-a]quinazolin-5(4H)-one
3-(4-chlorophenyl)-8-(4-phenylpiperazine-1-carbonyl)-1-sulfanylidene-1H-[1,3]thiazolo[3,4-a]quinazolin-5(4H)-one
Compound characteristics
| Compound ID: | K233-0950 |
| Compound Name: | 3-(4-chlorophenyl)-8-(4-phenylpiperazine-1-carbonyl)-1-sulfanylidene-1H-[1,3]thiazolo[3,4-a]quinazolin-5(4H)-one |
| Molecular Weight: | 533.07 |
| Molecular Formula: | C27 H21 Cl N4 O2 S2 |
| Smiles: | C1CN(CCN1C(c1ccc2C(NC3=C(c4ccc(cc4)[Cl])SC(N3c2c1)=S)=O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.8714 |
| logD: | 4.8714 |
| logSw: | -5.0304 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.613 |
| InChI Key: | RUNKKPIQNSNLKC-UHFFFAOYSA-N |