7-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-2-{[(3-fluorophenyl)methyl]sulfanyl}-3-(3-methoxyphenyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
7-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-2-{[(3-fluorophenyl)methyl]sulfanyl}-3-(3-methoxyphenyl)quinazolin-4(3H)-one
7-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-2-{[(3-fluorophenyl)methyl]sulfanyl}-3-(3-methoxyphenyl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | G859-0330 |
| Compound Name: | 7-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-2-{[(3-fluorophenyl)methyl]sulfanyl}-3-(3-methoxyphenyl)quinazolin-4(3H)-one |
| Molecular Weight: | 551.64 |
| Molecular Formula: | C32 H26 F N3 O3 S |
| Smiles: | COc1cccc(c1)N1C(=Nc2cc(ccc2C1=O)C(N1CCc2ccccc2C1)=O)SCc1cccc(c1)F |
| Stereo: | ACHIRAL |
| logP: | 5.4807 |
| logD: | 5.4805 |
| logSw: | -5.4289 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.014 |
| InChI Key: | NRXHPRDAEWOHEF-UHFFFAOYSA-N |