3-(3,4-dimethoxyphenyl)-2-{[(5-methyl-2-{4-[(propan-2-yl)oxy]phenyl}-1,3-oxazol-4-yl)methyl]sulfanyl}quinazolin-4(3H)-one
Chemical Structure Depiction of
3-(3,4-dimethoxyphenyl)-2-{[(5-methyl-2-{4-[(propan-2-yl)oxy]phenyl}-1,3-oxazol-4-yl)methyl]sulfanyl}quinazolin-4(3H)-one
3-(3,4-dimethoxyphenyl)-2-{[(5-methyl-2-{4-[(propan-2-yl)oxy]phenyl}-1,3-oxazol-4-yl)methyl]sulfanyl}quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | F413-0415 |
| Compound Name: | 3-(3,4-dimethoxyphenyl)-2-{[(5-methyl-2-{4-[(propan-2-yl)oxy]phenyl}-1,3-oxazol-4-yl)methyl]sulfanyl}quinazolin-4(3H)-one |
| Molecular Weight: | 543.64 |
| Molecular Formula: | C30 H29 N3 O5 S |
| Smiles: | CC(C)Oc1ccc(cc1)c1nc(CSC2=Nc3ccccc3C(N2c2ccc(c(c2)OC)OC)=O)c(C)o1 |
| Stereo: | ACHIRAL |
| logP: | 5.1326 |
| logD: | 5.1323 |
| logSw: | -4.9358 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.345 |
| InChI Key: | HTZJUIZGRFCIJA-UHFFFAOYSA-N |