LCS 22727
5-chloro-2-phenyl-3-(5H-tetrazol-5-ylmethylsulfanyl)-1H-indole
| Molecular Formula | C16H12ClN5S |
|---|---|
| Molecular Weight | 341.8 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 90.5 A2 |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 341.0502 |
| Heavy Atoms | 23 |
| Complexity | 455.0 |
Chemical Identifiers
| CAS Number | 66354-94-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=C(C3=C(N2)C=CC(=C3)Cl)SCC4N=NN=N4 |
| InChIKey | KPIGZOYPTSEXKY-UHFFFAOYSA-N |
📖 Product Overview
LCS 22727 (CAS: 66354-94-7) is a chemical compound with molecular formula C16H12ClN5S and molecular weight 341.8 g/mol. Its IUPAC systematic name is 5-chloro-2-phenyl-3-(5H-tetrazol-5-ylmethylsulfanyl)-1H-indole.
KPIGZOYPTSEXKY-UHFFFAOYSA-N.
SMILES: C1=CC=C(C=C1)C2=C(C3=C(N2)C=CC(=C3)Cl)SCC4N=NN=N4.
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