6-amino-2-{[(4-nitrophenyl)methyl]sulfanyl}pyrimidin-4-ol
Chemical Structure Depiction of
6-amino-2-{[(4-nitrophenyl)methyl]sulfanyl}pyrimidin-4-ol
6-amino-2-{[(4-nitrophenyl)methyl]sulfanyl}pyrimidin-4-ol
Compound characteristics
| Compound ID: | 8012-8120 |
| Compound Name: | 6-amino-2-{[(4-nitrophenyl)methyl]sulfanyl}pyrimidin-4-ol |
| Molecular Weight: | 278.29 |
| Molecular Formula: | C11 H10 N4 O3 S |
| Smiles: | C(c1ccc(cc1)[N+]([O-])=O)Sc1nc(cc(n1)O)N |
| Stereo: | ACHIRAL |
| logP: | 1.7617 |
| logD: | 1.5826 |
| logSw: | -2.068 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 88.537 |
| InChI Key: | RJJRKEFSOZXOAZ-UHFFFAOYSA-N |