2-{[(3-chlorophenyl)methyl]sulfanyl}-3-(3-fluorophenyl)-7-(pyrrolidine-1-carbonyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[(3-chlorophenyl)methyl]sulfanyl}-3-(3-fluorophenyl)-7-(pyrrolidine-1-carbonyl)quinazolin-4(3H)-one
2-{[(3-chlorophenyl)methyl]sulfanyl}-3-(3-fluorophenyl)-7-(pyrrolidine-1-carbonyl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | G859-0006 |
| Compound Name: | 2-{[(3-chlorophenyl)methyl]sulfanyl}-3-(3-fluorophenyl)-7-(pyrrolidine-1-carbonyl)quinazolin-4(3H)-one |
| Molecular Weight: | 493.99 |
| Molecular Formula: | C26 H21 Cl F N3 O2 S |
| Smiles: | C1CCN(C1)C(c1ccc2C(N(C(=Nc2c1)SCc1cccc(c1)[Cl])c1cccc(c1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.769 |
| logD: | 4.7689 |
| logSw: | -4.9856 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.174 |
| InChI Key: | GHCAIVFJZLKDFM-UHFFFAOYSA-N |