2-[4-[(4-fluorophenyl)sulfonylamino]phenyl]-N-(1H-indazol-7-yl)acetamide

C21H17FN4O3S — CID 34198690

IUPAC2-[4-[(4-fluorophenyl)sulfonylamino]phenyl]-N-(1H-indazol-7-yl)acetamide
SMILESO=C(Cc1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1)Nc1cccc2cn[nH]c12
InChIInChI=1S/C21H17FN4O3S/c22-16-6-10-18(11-7-16)30(28,29)26-17-8-4-14(5-9-17)12-20(27)24-19-3-1-2-15-13-23-25-21(15)19/h1-11,13,26H,12H2,(H,23,25)(H,24,27)
InChIKeyZBMYXDPQLAOSPC-UHFFFAOYSA-N
MW424.46 g/mol
LogP3.68
Rot. Bonds6

About 2-[4-[(4-fluorophenyl)sulfonylamino]phenyl]-N-(1H-indazol-7-yl)acetamide

2-[4-[(4-fluorophenyl)sulfonylamino]phenyl]-N-(1H-indazol-7-yl)acetamide (PubChem CID 34198690) has the molecular formula C21H17FN4O3S and a molecular weight of 424.46 g/mol. Its IUPAC name is 2-[4-[(4-fluorophenyl)sulfonylamino]phenyl]-N-(1H-indazol-7-yl)acetamide.

Molecular Properties

Compound Name2-[4-[(4-fluorophenyl)sulfonylamino]phenyl]-N-(1H-indazol-7-yl)acetamide
PubChem CID34198690
Molecular FormulaC21H17FN4O3S
Molecular Weight424.46 g/mol
Exact Mass424.10
IUPAC Name2-[4-[(4-fluorophenyl)sulfonylamino]phenyl]-N-(1H-indazol-7-yl)acetamide
SMILESO=C(Cc1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1)Nc1cccc2cn[nH]c12
InChIInChI=1S/C21H17FN4O3S/c22-16-6-10-18(11-7-16)30(28,29)26-17-8-4-14(5-9-17)12-20(27)24-19-3-1-2-15-13-23-25-21(15)19/h1-11,13,26H,12H2,(H,23,25)(H,24,27)
InChIKeyZBMYXDPQLAOSPC-UHFFFAOYSA-N
XLogP3.68
TPSA103.95 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.46
LogP ≤ 53.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 2-[4-[(4-fluorophenyl)sulfonylamino]phenyl]-N-(1H-indazol-7-yl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[4-[(4-fluorophenyl)sulfonylamino]phenyl]-N-(1H-indazol-7-yl)acetamide?
The IUPAC name of 2-[4-[(4-fluorophenyl)sulfonylamino]phenyl]-N-(1H-indazol-7-yl)acetamide (CID 34198690) is 2-[4-[(4-fluorophenyl)sulfonylamino]phenyl]-N-(1H-indazol-7-yl)acetamide.
What is the SMILES notation for 2-[4-[(4-fluorophenyl)sulfonylamino]phenyl]-N-(1H-indazol-7-yl)acetamide?
The canonical SMILES for 2-[4-[(4-fluorophenyl)sulfonylamino]phenyl]-N-(1H-indazol-7-yl)acetamide is O=C(Cc1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1)Nc1cccc2cn[nH]c12.
What is the InChIKey of 2-[4-[(4-fluorophenyl)sulfonylamino]phenyl]-N-(1H-indazol-7-yl)acetamide?
The InChIKey is ZBMYXDPQLAOSPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17FN4O3S/c22-16-6-10-18(11-7-16)30(28,29)26-17-8-4-14(5-9-17)12-20(27)24-19-3-1-2-15-13-23-25-21(15)19/h1-11,13,26H,12H2,(H,23,25)(H,24,27).
What are the key properties of 2-[4-[(4-fluorophenyl)sulfonylamino]phenyl]-N-(1H-indazol-7-yl)acetamide?
2-[4-[(4-fluorophenyl)sulfonylamino]phenyl]-N-(1H-indazol-7-yl)acetamide has a molecular weight of 424.46 g/mol, XLogP of 3.68, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(4-fluorophenyl)sulfonylamino]phenyl]-N-(1H-indazol-7-yl)acetamide is sourced from PubChem (CID 34198690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).