3-(4-bromophenyl)-4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]-1-sulfanylidene-1H-[1,3]thiazolo[3,4-a]quinazolin-5(4H)-one
Chemical Structure Depiction of
3-(4-bromophenyl)-4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]-1-sulfanylidene-1H-[1,3]thiazolo[3,4-a]quinazolin-5(4H)-one
3-(4-bromophenyl)-4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]-1-sulfanylidene-1H-[1,3]thiazolo[3,4-a]quinazolin-5(4H)-one
Compound characteristics
| Compound ID: | F369-0346 |
| Compound Name: | 3-(4-bromophenyl)-4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]-1-sulfanylidene-1H-[1,3]thiazolo[3,4-a]quinazolin-5(4H)-one |
| Molecular Weight: | 528.49 |
| Molecular Formula: | C24 H22 Br N3 O2 S2 |
| Smiles: | CC1CCCCN1C(CN1C2=C(c3ccc(cc3)[Br])SC(N2c2ccccc2C1=O)=S)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1232 |
| logD: | 5.1232 |
| logSw: | -4.8815 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 33.465 |
| InChI Key: | PBTPPDNOFNWDJI-HNNXBMFYSA-N |