2-({[3-(3-bromophenyl)-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-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-7-phenyl-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
2-({[3-(3-bromophenyl)-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: | C200-8938 |
| Compound Name: | 2-({[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-7-phenyl-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one |
| Molecular Weight: | 480.34 |
| Molecular Formula: | C21 H14 Br N5 O2 S |
| Smiles: | C(c1nc(c2cccc(c2)[Br])no1)SC1NC(c2c(c(c[nH]2)c2ccccc2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3339 |
| logD: | 5.332 |
| logSw: | -5.637 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.337 |
| InChI Key: | YCISOPLSSWUHPT-UHFFFAOYSA-N |