2-{[4-(propan-2-yl)phenoxy]methyl}-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
Chemical Structure Depiction of
2-{[4-(propan-2-yl)phenoxy]methyl}-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
2-{[4-(propan-2-yl)phenoxy]methyl}-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
Compound characteristics
| Compound ID: | Y205-8020 |
| Compound Name: | 2-{[4-(propan-2-yl)phenoxy]methyl}-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one |
| Molecular Weight: | 351.43 |
| Molecular Formula: | C19 H17 N3 O2 S |
| Smiles: | CC(C)c1ccc(cc1)OCC1=NN2C(=Nc3ccccc3C2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 4.1427 |
| logD: | 4.1426 |
| logSw: | -4.3051 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.933 |
| InChI Key: | LNQUONXOFLWNQT-UHFFFAOYSA-N |