3,3'-(propane-1,3-diyl)bis[2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}quinazolin-4(3H)-one]
Chemical Structure Depiction of
3,3'-(propane-1,3-diyl)bis[2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}quinazolin-4(3H)-one]
3,3'-(propane-1,3-diyl)bis[2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}quinazolin-4(3H)-one]
Compound characteristics
| Compound ID: | K284-7460 |
| Compound Name: | 3,3'-(propane-1,3-diyl)bis[2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}quinazolin-4(3H)-one] |
| Molecular Weight: | 681.61 |
| Molecular Formula: | C33 H24 Cl2 F2 N4 O2 S2 |
| Smiles: | C(CN1C(=Nc2ccccc2C1=O)SCc1ccc(cc1[Cl])F)CN1C(=Nc2ccccc2C1=O)SCc1ccc(cc1[Cl])F |
| Stereo: | ACHIRAL |
| logP: | 7.8103 |
| logD: | 7.8103 |
| logSw: | -6.6566 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 51.532 |
| InChI Key: | AOJMRNZJKSFWRD-UHFFFAOYSA-N |