2-[(4-chloro-3-methylphenoxy)methyl]-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
Chemical Structure Depiction of
2-[(4-chloro-3-methylphenoxy)methyl]-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
2-[(4-chloro-3-methylphenoxy)methyl]-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
Compound characteristics
| Compound ID: | Y205-8139 |
| Compound Name: | 2-[(4-chloro-3-methylphenoxy)methyl]-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one |
| Molecular Weight: | 357.82 |
| Molecular Formula: | C17 H12 Cl N3 O2 S |
| Smiles: | Cc1cc(ccc1[Cl])OCC1=NN2C(=Nc3ccccc3C2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 4.0839 |
| logD: | 4.0838 |
| logSw: | -4.4381 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.933 |
| InChI Key: | WIILZHUCDBCWPI-UHFFFAOYSA-N |