8-[(2,4-dinitrophenyl)sulfanyl]-9H-purin-6-amine
Chemical Structure Depiction of
8-[(2,4-dinitrophenyl)sulfanyl]-9H-purin-6-amine
8-[(2,4-dinitrophenyl)sulfanyl]-9H-purin-6-amine
Compound characteristics
| Compound ID: | 4327-2945 |
| Compound Name: | 8-[(2,4-dinitrophenyl)sulfanyl]-9H-purin-6-amine |
| Molecular Weight: | 333.28 |
| Molecular Formula: | C11 H7 N7 O4 S |
| Smiles: | c1cc(c(cc1[N+]([O-])=O)[N+]([O-])=O)Sc1nc2c(N)ncnc2[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 2.0995 |
| logD: | 0.6274 |
| logSw: | -2.8598 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 127.045 |
| InChI Key: | XODWXTLRCXECTL-UHFFFAOYSA-N |