2-(benzylsulfanyl)-7-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-3-(3-fluorophenyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
2-(benzylsulfanyl)-7-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-3-(3-fluorophenyl)quinazolin-4(3H)-one
2-(benzylsulfanyl)-7-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-3-(3-fluorophenyl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | G859-0061 |
| Compound Name: | 2-(benzylsulfanyl)-7-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-3-(3-fluorophenyl)quinazolin-4(3H)-one |
| Molecular Weight: | 521.61 |
| Molecular Formula: | C31 H24 F N3 O2 S |
| Smiles: | C1CN(Cc2ccccc12)C(c1ccc2C(N(C(=Nc2c1)SCc1ccccc1)c1cccc(c1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9926 |
| logD: | 4.9925 |
| logSw: | -4.9216 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.47 |
| InChI Key: | HTHUPCXOLFKBJC-UHFFFAOYSA-N |