2-({[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-7-phenyl-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
Chemical Structure Depiction of
2-({[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-7-phenyl-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
2-({[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-7-phenyl-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | C200-8945 |
| Compound Name: | 2-({[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-7-phenyl-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one |
| Molecular Weight: | 415.47 |
| Molecular Formula: | C22 H17 N5 O2 S |
| Smiles: | Cc1ccc(cc1)c1nc(CSC2NC(c3c(c(c[nH]3)c3ccccc3)N=2)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.9102 |
| logD: | 4.9083 |
| logSw: | -4.6814 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.337 |
| InChI Key: | GSEOLTNJIGGHTA-UHFFFAOYSA-N |