7-fluoro-6-[4-(methanesulfonamido)phenyl]indazole-1-carboxamide

C15H13FN4O3S — CID 173170831

IUPAC7-fluoro-6-[4-(methanesulfonamido)phenyl]indazole-1-carboxamide
SMILESCS(=O)(=O)Nc1ccc(-c2ccc3cnn(C(N)=O)c3c2F)cc1
InChIInChI=1S/C15H13FN4O3S/c1-24(22,23)19-11-5-2-9(3-6-11)12-7-4-10-8-18-20(15(17)21)14(10)13(12)16/h2-8,19H,1H3,(H2,17,21)
InChIKeyONXFFQHPZSNFFA-UHFFFAOYSA-N
MW348.36 g/mol
LogP2.14
Rot. Bonds3

About 7-fluoro-6-[4-(methanesulfonamido)phenyl]indazole-1-carboxamide

7-fluoro-6-[4-(methanesulfonamido)phenyl]indazole-1-carboxamide (PubChem CID 173170831) has the molecular formula C15H13FN4O3S and a molecular weight of 348.36 g/mol. Its IUPAC name is 7-fluoro-6-[4-(methanesulfonamido)phenyl]indazole-1-carboxamide.

Molecular Properties

Compound Name7-fluoro-6-[4-(methanesulfonamido)phenyl]indazole-1-carboxamide
PubChem CID173170831
Molecular FormulaC15H13FN4O3S
Molecular Weight348.36 g/mol
Exact Mass348.07
IUPAC Name7-fluoro-6-[4-(methanesulfonamido)phenyl]indazole-1-carboxamide
SMILESCS(=O)(=O)Nc1ccc(-c2ccc3cnn(C(N)=O)c3c2F)cc1
InChIInChI=1S/C15H13FN4O3S/c1-24(22,23)19-11-5-2-9(3-6-11)12-7-4-10-8-18-20(15(17)21)14(10)13(12)16/h2-8,19H,1H3,(H2,17,21)
InChIKeyONXFFQHPZSNFFA-UHFFFAOYSA-N
XLogP2.14
TPSA107.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.36
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-fluoro-6-[4-(methanesulfonamido)phenyl]indazole-1-carboxamide?
The IUPAC name of 7-fluoro-6-[4-(methanesulfonamido)phenyl]indazole-1-carboxamide (CID 173170831) is 7-fluoro-6-[4-(methanesulfonamido)phenyl]indazole-1-carboxamide.
What is the SMILES notation for 7-fluoro-6-[4-(methanesulfonamido)phenyl]indazole-1-carboxamide?
The canonical SMILES for 7-fluoro-6-[4-(methanesulfonamido)phenyl]indazole-1-carboxamide is CS(=O)(=O)Nc1ccc(-c2ccc3cnn(C(N)=O)c3c2F)cc1.
What is the InChIKey of 7-fluoro-6-[4-(methanesulfonamido)phenyl]indazole-1-carboxamide?
The InChIKey is ONXFFQHPZSNFFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13FN4O3S/c1-24(22,23)19-11-5-2-9(3-6-11)12-7-4-10-8-18-20(15(17)21)14(10)13(12)16/h2-8,19H,1H3,(H2,17,21).
What are the key properties of 7-fluoro-6-[4-(methanesulfonamido)phenyl]indazole-1-carboxamide?
7-fluoro-6-[4-(methanesulfonamido)phenyl]indazole-1-carboxamide has a molecular weight of 348.36 g/mol, XLogP of 2.14, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-6-[4-(methanesulfonamido)phenyl]indazole-1-carboxamide is sourced from PubChem (CID 173170831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).