4-methyl-6-(4-nitrophenoxy)-2-{[(3-nitrophenyl)methyl]sulfanyl}pyrimidine
Chemical Structure Depiction of
4-methyl-6-(4-nitrophenoxy)-2-{[(3-nitrophenyl)methyl]sulfanyl}pyrimidine
4-methyl-6-(4-nitrophenoxy)-2-{[(3-nitrophenyl)methyl]sulfanyl}pyrimidine
Compound characteristics
| Compound ID: | V022-8032 |
| Compound Name: | 4-methyl-6-(4-nitrophenoxy)-2-{[(3-nitrophenyl)methyl]sulfanyl}pyrimidine |
| Molecular Weight: | 398.4 |
| Molecular Formula: | C18 H14 N4 O5 S |
| Salt: | not_available |
| Smiles: | Cc1cc(nc(n1)SCc1cccc(c1)[N+]([O-])=O)Oc1ccc(cc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.5793 |
| logD: | 4.5793 |
| logSw: | -4.5892 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 90.478 |
| InChI Key: | QVQZCAJNWLEUNC-UHFFFAOYSA-N |