2-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-3-(4-fluorophenyl)-7-(pyrrolidine-1-carbonyl)quinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-3-(4-fluorophenyl)-7-(pyrrolidine-1-carbonyl)quinazolin-4(3H)-one
2-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-3-(4-fluorophenyl)-7-(pyrrolidine-1-carbonyl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | G858-0458 |
| Compound Name: | 2-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-3-(4-fluorophenyl)-7-(pyrrolidine-1-carbonyl)quinazolin-4(3H)-one |
| Molecular Weight: | 511.98 |
| Molecular Formula: | C26 H20 Cl F2 N3 O2 S |
| Smiles: | C1CCN(C1)C(c1ccc2C(N(C(=Nc2c1)SCc1c(cccc1[Cl])F)c1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8162 |
| logD: | 4.8161 |
| logSw: | -4.9602 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.174 |
| InChI Key: | WCVNACMYDNTZLV-UHFFFAOYSA-N |