4-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]-3-(3-methylphenyl)-1-sulfanylidene-1H-[1,3]thiazolo[3,4-a]quinazolin-5(4H)-one
Chemical Structure Depiction of
4-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]-3-(3-methylphenyl)-1-sulfanylidene-1H-[1,3]thiazolo[3,4-a]quinazolin-5(4H)-one
4-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]-3-(3-methylphenyl)-1-sulfanylidene-1H-[1,3]thiazolo[3,4-a]quinazolin-5(4H)-one
Compound characteristics
| Compound ID: | C746-0660 |
| Compound Name: | 4-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]-3-(3-methylphenyl)-1-sulfanylidene-1H-[1,3]thiazolo[3,4-a]quinazolin-5(4H)-one |
| Molecular Weight: | 477.65 |
| Molecular Formula: | C26 H27 N3 O2 S2 |
| Smiles: | CCC1CCCCN1C(CN1C2=C(c3cccc(C)c3)SC(N2c2ccccc2C1=O)=S)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0006 |
| logD: | 5.0006 |
| logSw: | -4.6323 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 33.827 |
| InChI Key: | RHMUKAOHUUKAFP-IBGZPJMESA-N |