3,3'-(ethane-1,2-diyl)bis[2-{[(2,5-dimethylphenyl)methyl]sulfanyl}quinazolin-4(3H)-one]
Chemical Structure Depiction of
3,3'-(ethane-1,2-diyl)bis[2-{[(2,5-dimethylphenyl)methyl]sulfanyl}quinazolin-4(3H)-one]
3,3'-(ethane-1,2-diyl)bis[2-{[(2,5-dimethylphenyl)methyl]sulfanyl}quinazolin-4(3H)-one]
Compound characteristics
| Compound ID: | K284-7601 |
| Compound Name: | 3,3'-(ethane-1,2-diyl)bis[2-{[(2,5-dimethylphenyl)methyl]sulfanyl}quinazolin-4(3H)-one] |
| Molecular Weight: | 618.82 |
| Molecular Formula: | C36 H34 N4 O2 S2 |
| Smiles: | Cc1ccc(C)c(CSC2=Nc3ccccc3C(N2CCN2C(=Nc3ccccc3C2=O)SCc2cc(C)ccc2C)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 8.3311 |
| logD: | 8.3311 |
| logSw: | -5.6726 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 51.532 |
| InChI Key: | QYMMAQMXZGAWJA-UHFFFAOYSA-N |