6-methoxy-2-[(4-methylphenyl)sulfanyl]-3-nitro-1H-indole
Chemical Structure Depiction of
6-methoxy-2-[(4-methylphenyl)sulfanyl]-3-nitro-1H-indole
6-methoxy-2-[(4-methylphenyl)sulfanyl]-3-nitro-1H-indole
Compound characteristics
| Compound ID: | 6881-0921 |
| Compound Name: | 6-methoxy-2-[(4-methylphenyl)sulfanyl]-3-nitro-1H-indole |
| Molecular Weight: | 314.36 |
| Molecular Formula: | C16 H14 N2 O3 S |
| Smiles: | Cc1ccc(cc1)Sc1c(c2ccc(cc2[nH]1)OC)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 5.082 |
| logD: | 5.082 |
| logSw: | -5.0895 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.771 |
| InChI Key: | NGRINRFSALDIHX-UHFFFAOYSA-N |