3-(3-methylbutyl)-2-({[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)[1]benzofuro[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-(3-methylbutyl)-2-({[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)[1]benzofuro[3,2-d]pyrimidin-4(3H)-one
3-(3-methylbutyl)-2-({[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)[1]benzofuro[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | C200-9406 |
| Compound Name: | 3-(3-methylbutyl)-2-({[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)[1]benzofuro[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 460.55 |
| Molecular Formula: | C25 H24 N4 O3 S |
| Smiles: | CC(C)CCN1C(=Nc2c3ccccc3oc2C1=O)SCc1nc(c2cccc(C)c2)no1 |
| Stereo: | ACHIRAL |
| logP: | 6.7329 |
| logD: | 6.7329 |
| logSw: | -5.8083 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.259 |
| InChI Key: | CTCQOQJFRZHRAW-UHFFFAOYSA-N |