4-{[(9H-purin-6-yl)sulfanyl]methyl}quinolin-2(1H)-one
Chemical Structure Depiction of
4-{[(9H-purin-6-yl)sulfanyl]methyl}quinolin-2(1H)-one
4-{[(9H-purin-6-yl)sulfanyl]methyl}quinolin-2(1H)-one
Compound characteristics
| Compound ID: | 8018-3947 |
| Compound Name: | 4-{[(9H-purin-6-yl)sulfanyl]methyl}quinolin-2(1H)-one |
| Molecular Weight: | 309.35 |
| Molecular Formula: | C15 H11 N5 O S |
| Smiles: | C(C1=CC(Nc2ccccc12)=O)Sc1c2c(ncn1)[nH]cn2 |
| Stereo: | ACHIRAL |
| logP: | 1.7235 |
| logD: | 1.7233 |
| logSw: | -2.6989 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.355 |
| InChI Key: | XZLYVEJHSCXPPH-UHFFFAOYSA-N |