4-{[(4-chlorophenyl)methyl]sulfanyl}-3-(1,3-dioxolan-2-yl)-6-nitro-1-phenyl-1H-indazole
Chemical Structure Depiction of
4-{[(4-chlorophenyl)methyl]sulfanyl}-3-(1,3-dioxolan-2-yl)-6-nitro-1-phenyl-1H-indazole
4-{[(4-chlorophenyl)methyl]sulfanyl}-3-(1,3-dioxolan-2-yl)-6-nitro-1-phenyl-1H-indazole
Compound characteristics
| Compound ID: | 8012-7632 |
| Compound Name: | 4-{[(4-chlorophenyl)methyl]sulfanyl}-3-(1,3-dioxolan-2-yl)-6-nitro-1-phenyl-1H-indazole |
| Molecular Weight: | 467.93 |
| Molecular Formula: | C23 H18 Cl N3 O4 S |
| Smiles: | C1COC(c2c3c(cc(cc3n(c3ccccc3)n2)[N+]([O-])=O)SCc2ccc(cc2)[Cl])O1 |
| Stereo: | ACHIRAL |
| logP: | 5.1875 |
| logD: | 5.1875 |
| logSw: | -5.8385 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.245 |
| InChI Key: | VWTXKMMHCIMRHB-UHFFFAOYSA-N |