2-(benzylsulfanyl)-7-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-3-(3-methoxyphenyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
2-(benzylsulfanyl)-7-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-3-(3-methoxyphenyl)quinazolin-4(3H)-one
2-(benzylsulfanyl)-7-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-3-(3-methoxyphenyl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | G859-0334 |
| Compound Name: | 2-(benzylsulfanyl)-7-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-3-(3-methoxyphenyl)quinazolin-4(3H)-one |
| Molecular Weight: | 533.65 |
| Molecular Formula: | C32 H27 N3 O3 S |
| Smiles: | COc1cccc(c1)N1C(=Nc2cc(ccc2C1=O)C(N1CCc2ccccc2C1)=O)SCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.081 |
| logD: | 5.0808 |
| logSw: | -4.8957 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.014 |
| InChI Key: | XREKSOQYUVPNEN-UHFFFAOYSA-N |