2-{[(5-methyl-2-{4-[(propan-2-yl)oxy]phenyl}-1,3-oxazol-4-yl)methyl]sulfanyl}-3-(propan-2-yl)quinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[(5-methyl-2-{4-[(propan-2-yl)oxy]phenyl}-1,3-oxazol-4-yl)methyl]sulfanyl}-3-(propan-2-yl)quinazolin-4(3H)-one
2-{[(5-methyl-2-{4-[(propan-2-yl)oxy]phenyl}-1,3-oxazol-4-yl)methyl]sulfanyl}-3-(propan-2-yl)quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | F413-0075 |
| Compound Name: | 2-{[(5-methyl-2-{4-[(propan-2-yl)oxy]phenyl}-1,3-oxazol-4-yl)methyl]sulfanyl}-3-(propan-2-yl)quinazolin-4(3H)-one |
| Molecular Weight: | 449.57 |
| Molecular Formula: | C25 H27 N3 O3 S |
| Smiles: | CC(C)N1C(=Nc2ccccc2C1=O)SCc1c(C)oc(c2ccc(cc2)OC(C)C)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.1914 |
| logD: | 5.1914 |
| logSw: | -4.9945 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.688 |
| InChI Key: | WRSMPYCKWXGEHR-UHFFFAOYSA-N |