6-chloro-7-(3-methyl-2-pyridinyl)-1H-indole-3-sulfonyl chloride

C14H10Cl2N2O2S — CID 170742564

IUPAC6-chloro-7-(3-methyl-2-pyridinyl)-1H-indole-3-sulfonyl chloride
SMILESCc1cccnc1-c1c(Cl)ccc2c(S(=O)(=O)Cl)c[nH]c12
InChIInChI=1S/C14H10Cl2N2O2S/c1-8-3-2-6-17-13(8)12-10(15)5-4-9-11(21(16,19)20)7-18-14(9)12/h2-7,18H,1H3
InChIKeyQJVCAFXJBCIBNV-UHFFFAOYSA-N
MW341.22 g/mol
LogP4.12
Rot. Bonds2

About 6-chloro-7-(3-methyl-2-pyridinyl)-1H-indole-3-sulfonyl chloride

6-chloro-7-(3-methyl-2-pyridinyl)-1H-indole-3-sulfonyl chloride (PubChem CID 170742564) has the molecular formula C14H10Cl2N2O2S and a molecular weight of 341.22 g/mol. Its IUPAC name is 6-chloro-7-(3-methyl-2-pyridinyl)-1H-indole-3-sulfonyl chloride.

Molecular Properties

Compound Name6-chloro-7-(3-methyl-2-pyridinyl)-1H-indole-3-sulfonyl chloride
PubChem CID170742564
Molecular FormulaC14H10Cl2N2O2S
Molecular Weight341.22 g/mol
Exact Mass339.98
IUPAC Name6-chloro-7-(3-methyl-2-pyridinyl)-1H-indole-3-sulfonyl chloride
SMILESCc1cccnc1-c1c(Cl)ccc2c(S(=O)(=O)Cl)c[nH]c12
InChIInChI=1S/C14H10Cl2N2O2S/c1-8-3-2-6-17-13(8)12-10(15)5-4-9-11(21(16,19)20)7-18-14(9)12/h2-7,18H,1H3
InChIKeyQJVCAFXJBCIBNV-UHFFFAOYSA-N
XLogP4.12
TPSA62.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.22
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,6-dichlorophenyl)-3-methylpyridine
CID 118841939
7-chloro-1H-pyrrolo[2,3-c]pyridine-3-sulfonyl chloride
CID 91619175
6-chloro-7-(1,2,4-triazol-4-yl)-1H-indole-3-sulfonyl chloride
CID 170742696
7-pyrazin-2-yl-1H-indole-3-sulfonyl chloride
CID 170742496
4,7-dichloro-1H-indole-3-sulfonyl chloride
CID 82374063
5-chloroquinoline-8-sulfonyl chloride
CID 4206949
6,7-dichloro-1H-indole;6,7-dichloro-1H-indole-3-sulfonyl chloride;sulfurochloridic acid
CID 158258905
6-bromo-7-(1-methylpyrazol-4-yl)-1H-indole-3-sulfonyl chloride
CID 170742571
7,8-dichloro-1-oxo-2H-isoquinoline-4-sulfonyl chloride
CID 170733590
6-chloro-N-(4-chloro-5-fluoro-2-methylphenyl)-7-methyl-1H-indole-3-sulfonamide
CID 163553285
2-(3,4-dichlorophenoxy)pyridine-3-sulfonyl chloride
CID 112573023
1-oxo-2H-isoquinoline-4-sulfonyl chloride
CID 86598072

Frequently Asked Questions

What is the IUPAC name of 6-chloro-7-(3-methyl-2-pyridinyl)-1H-indole-3-sulfonyl chloride?
The IUPAC name of 6-chloro-7-(3-methyl-2-pyridinyl)-1H-indole-3-sulfonyl chloride (CID 170742564) is 6-chloro-7-(3-methyl-2-pyridinyl)-1H-indole-3-sulfonyl chloride.
What is the SMILES notation for 6-chloro-7-(3-methyl-2-pyridinyl)-1H-indole-3-sulfonyl chloride?
The canonical SMILES for 6-chloro-7-(3-methyl-2-pyridinyl)-1H-indole-3-sulfonyl chloride is Cc1cccnc1-c1c(Cl)ccc2c(S(=O)(=O)Cl)c[nH]c12.
What is the InChIKey of 6-chloro-7-(3-methyl-2-pyridinyl)-1H-indole-3-sulfonyl chloride?
The InChIKey is QJVCAFXJBCIBNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Cl2N2O2S/c1-8-3-2-6-17-13(8)12-10(15)5-4-9-11(21(16,19)20)7-18-14(9)12/h2-7,18H,1H3.
What are the key properties of 6-chloro-7-(3-methyl-2-pyridinyl)-1H-indole-3-sulfonyl chloride?
6-chloro-7-(3-methyl-2-pyridinyl)-1H-indole-3-sulfonyl chloride has a molecular weight of 341.22 g/mol, XLogP of 4.12, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-7-(3-methyl-2-pyridinyl)-1H-indole-3-sulfonyl chloride is sourced from PubChem (CID 170742564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).