2-[(4-chlorophenyl)sulfanyl]-4,7-dimethyl-3-nitro-1H-indole
Chemical Structure Depiction of
2-[(4-chlorophenyl)sulfanyl]-4,7-dimethyl-3-nitro-1H-indole
2-[(4-chlorophenyl)sulfanyl]-4,7-dimethyl-3-nitro-1H-indole
Compound characteristics
| Compound ID: | 6881-0937 |
| Compound Name: | 2-[(4-chlorophenyl)sulfanyl]-4,7-dimethyl-3-nitro-1H-indole |
| Molecular Weight: | 332.81 |
| Molecular Formula: | C16 H13 Cl N2 O2 S |
| Smiles: | Cc1ccc(C)c2c1c(c([nH]2)Sc1ccc(cc1)[Cl])[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 6.1122 |
| logD: | 6.1122 |
| logSw: | -6.381 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.998 |
| InChI Key: | IPOATKUMAIWPIF-UHFFFAOYSA-N |