6-chloro-N-(5-chloro-3-fluoro-6-methyl-2-pyridinyl)-1H-indole-3-sulfonamide

C14H10Cl2FN3O2S — CID 135187170

IUPAC6-chloro-N-(5-chloro-3-fluoro-6-methyl-2-pyridinyl)-1H-indole-3-sulfonamide
SMILESCc1nc(NS(=O)(=O)c2c[nH]c3cc(Cl)ccc23)c(F)cc1Cl
InChIInChI=1S/C14H10Cl2FN3O2S/c1-7-10(16)5-11(17)14(19-7)20-23(21,22)13-6-18-12-4-8(15)2-3-9(12)13/h2-6,18H,1H3,(H,19,20)
InChIKeyFQBLAYCNVKVEDS-UHFFFAOYSA-N
MW374.22 g/mol
LogP4.12
Rot. Bonds3

About 6-chloro-N-(5-chloro-3-fluoro-6-methyl-2-pyridinyl)-1H-indole-3-sulfonamide

6-chloro-N-(5-chloro-3-fluoro-6-methyl-2-pyridinyl)-1H-indole-3-sulfonamide (PubChem CID 135187170) has the molecular formula C14H10Cl2FN3O2S and a molecular weight of 374.22 g/mol. Its IUPAC name is 6-chloro-N-(5-chloro-3-fluoro-6-methyl-2-pyridinyl)-1H-indole-3-sulfonamide.

Molecular Properties

Compound Name6-chloro-N-(5-chloro-3-fluoro-6-methyl-2-pyridinyl)-1H-indole-3-sulfonamide
PubChem CID135187170
Molecular FormulaC14H10Cl2FN3O2S
Molecular Weight374.22 g/mol
Exact Mass372.99
IUPAC Name6-chloro-N-(5-chloro-3-fluoro-6-methyl-2-pyridinyl)-1H-indole-3-sulfonamide
SMILESCc1nc(NS(=O)(=O)c2c[nH]c3cc(Cl)ccc23)c(F)cc1Cl
InChIInChI=1S/C14H10Cl2FN3O2S/c1-7-10(16)5-11(17)14(19-7)20-23(21,22)13-6-18-12-4-8(15)2-3-9(12)13/h2-6,18H,1H3,(H,19,20)
InChIKeyFQBLAYCNVKVEDS-UHFFFAOYSA-N
XLogP4.12
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.22
LogP ≤ 54.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(5-chloro-3-fluoro-6-methyl-2-pyridinyl)-1H-indole-3-sulfonamide?
The IUPAC name of 6-chloro-N-(5-chloro-3-fluoro-6-methyl-2-pyridinyl)-1H-indole-3-sulfonamide (CID 135187170) is 6-chloro-N-(5-chloro-3-fluoro-6-methyl-2-pyridinyl)-1H-indole-3-sulfonamide.
What is the SMILES notation for 6-chloro-N-(5-chloro-3-fluoro-6-methyl-2-pyridinyl)-1H-indole-3-sulfonamide?
The canonical SMILES for 6-chloro-N-(5-chloro-3-fluoro-6-methyl-2-pyridinyl)-1H-indole-3-sulfonamide is Cc1nc(NS(=O)(=O)c2c[nH]c3cc(Cl)ccc23)c(F)cc1Cl.
What is the InChIKey of 6-chloro-N-(5-chloro-3-fluoro-6-methyl-2-pyridinyl)-1H-indole-3-sulfonamide?
The InChIKey is FQBLAYCNVKVEDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Cl2FN3O2S/c1-7-10(16)5-11(17)14(19-7)20-23(21,22)13-6-18-12-4-8(15)2-3-9(12)13/h2-6,18H,1H3,(H,19,20).
What are the key properties of 6-chloro-N-(5-chloro-3-fluoro-6-methyl-2-pyridinyl)-1H-indole-3-sulfonamide?
6-chloro-N-(5-chloro-3-fluoro-6-methyl-2-pyridinyl)-1H-indole-3-sulfonamide has a molecular weight of 374.22 g/mol, XLogP of 4.12, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(5-chloro-3-fluoro-6-methyl-2-pyridinyl)-1H-indole-3-sulfonamide is sourced from PubChem (CID 135187170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).