3-(1,3-dioxolan-2-yl)-4-[(2-methylpropyl)sulfanyl]-6-nitro-1-phenyl-1H-indazole
Chemical Structure Depiction of
3-(1,3-dioxolan-2-yl)-4-[(2-methylpropyl)sulfanyl]-6-nitro-1-phenyl-1H-indazole
3-(1,3-dioxolan-2-yl)-4-[(2-methylpropyl)sulfanyl]-6-nitro-1-phenyl-1H-indazole
Compound characteristics
| Compound ID: | 8012-7633 |
| Compound Name: | 3-(1,3-dioxolan-2-yl)-4-[(2-methylpropyl)sulfanyl]-6-nitro-1-phenyl-1H-indazole |
| Molecular Weight: | 399.47 |
| Molecular Formula: | C20 H21 N3 O4 S |
| Smiles: | CC(C)CSc1cc(cc2c1c(C1OCCO1)nn2c1ccccc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.7116 |
| logD: | 4.7116 |
| logSw: | -4.621 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.517 |
| InChI Key: | UMUNTHXWAXUQCB-UHFFFAOYSA-N |