N-[4-[2-chloro-5-(1,3-thiazol-2-yl)phenyl]phenyl]-3-fluoropyridine-2-sulfonamide

C20H13ClFN3O2S2 — CID 24831422

IUPACN-[4-[2-chloro-5-(1,3-thiazol-2-yl)phenyl]phenyl]-3-fluoropyridine-2-sulfonamide
SMILESO=S(=O)(Nc1ccc(-c2cc(-c3nccs3)ccc2Cl)cc1)c1ncccc1F
InChIInChI=1S/C20H13ClFN3O2S2/c21-17-8-5-14(19-23-10-11-28-19)12-16(17)13-3-6-15(7-4-13)25-29(26,27)20-18(22)2-1-9-24-20/h1-12,25H
InChIKeyGLCUOMXDAMEYAY-UHFFFAOYSA-N
MW445.93 g/mol
LogP5.47
Rot. Bonds5

About N-[4-[2-chloro-5-(1,3-thiazol-2-yl)phenyl]phenyl]-3-fluoropyridine-2-sulfonamide

N-[4-[2-chloro-5-(1,3-thiazol-2-yl)phenyl]phenyl]-3-fluoropyridine-2-sulfonamide (PubChem CID 24831422) has the molecular formula C20H13ClFN3O2S2 and a molecular weight of 445.93 g/mol. Its IUPAC name is N-[4-[2-chloro-5-(1,3-thiazol-2-yl)phenyl]phenyl]-3-fluoropyridine-2-sulfonamide.

Molecular Properties

Compound NameN-[4-[2-chloro-5-(1,3-thiazol-2-yl)phenyl]phenyl]-3-fluoropyridine-2-sulfonamide
PubChem CID24831422
Molecular FormulaC20H13ClFN3O2S2
Molecular Weight445.93 g/mol
Exact Mass445.01
IUPAC NameN-[4-[2-chloro-5-(1,3-thiazol-2-yl)phenyl]phenyl]-3-fluoropyridine-2-sulfonamide
SMILESO=S(=O)(Nc1ccc(-c2cc(-c3nccs3)ccc2Cl)cc1)c1ncccc1F
InChIInChI=1S/C20H13ClFN3O2S2/c21-17-8-5-14(19-23-10-11-28-19)12-16(17)13-3-6-15(7-4-13)25-29(26,27)20-18(22)2-1-9-24-20/h1-12,25H
InChIKeyGLCUOMXDAMEYAY-UHFFFAOYSA-N
XLogP5.47
TPSA71.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500445.93
LogP ≤ 55.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[4-[2-chloro-5-(1,3-thiazol-2-yl)phenyl]phenyl]-3-fluoropyridine-2-sulfonamide with MolForge

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

Launch Full Analysis

Related Compounds

3,5-difluoro-N-[4-[2-methyl-5-(1,3-thiazol-2-yl)phenyl]phenyl]pyridine-2-sulfonamide
CID 24831260
N-(3,4-dichlorophenyl)-3-fluoropyridine-2-sulfonamide
CID 103299127
N-(4-chloro-3-cyanophenyl)-3-fluoropyridine-2-sulfonamide
CID 103299415
2-chloro-4-[(3-fluoro-2-pyridinyl)sulfonylamino]benzoic acid
CID 103298758
N-(2,3-dichlorophenyl)-3-fluoropyridine-2-sulfonamide
CID 103299163
3-fluoro-N-naphthalen-2-ylpyridine-2-sulfonamide
CID 103299396
4-[(3-fluoro-2-pyridinyl)sulfonylamino]benzamide
CID 103299122
4-[(3-fluoro-2-pyridinyl)sulfonylamino]benzenecarbothioamide
CID 103300634
N-[4-(1-aminoethyl)phenyl]-3-fluoropyridine-2-sulfonamide
CID 103298978
N-[5-[2-chloro-5-(1,3-thiazol-2-yl)phenyl]-2-pyridinyl]-2-fluoro-6-(trifluoromethyl)benzamide
CID 25181726
N-[4-(2-aminoethoxy)phenyl]-3-fluoropyridine-2-sulfonamide
CID 103298449
3-fluoro-N-(2-fluorophenyl)pyridine-2-sulfonamide
CID 103299037

Frequently Asked Questions

What is the IUPAC name of N-[4-[2-chloro-5-(1,3-thiazol-2-yl)phenyl]phenyl]-3-fluoropyridine-2-sulfonamide?
The IUPAC name of N-[4-[2-chloro-5-(1,3-thiazol-2-yl)phenyl]phenyl]-3-fluoropyridine-2-sulfonamide (CID 24831422) is N-[4-[2-chloro-5-(1,3-thiazol-2-yl)phenyl]phenyl]-3-fluoropyridine-2-sulfonamide.
What is the SMILES notation for N-[4-[2-chloro-5-(1,3-thiazol-2-yl)phenyl]phenyl]-3-fluoropyridine-2-sulfonamide?
The canonical SMILES for N-[4-[2-chloro-5-(1,3-thiazol-2-yl)phenyl]phenyl]-3-fluoropyridine-2-sulfonamide is O=S(=O)(Nc1ccc(-c2cc(-c3nccs3)ccc2Cl)cc1)c1ncccc1F.
What is the InChIKey of N-[4-[2-chloro-5-(1,3-thiazol-2-yl)phenyl]phenyl]-3-fluoropyridine-2-sulfonamide?
The InChIKey is GLCUOMXDAMEYAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H13ClFN3O2S2/c21-17-8-5-14(19-23-10-11-28-19)12-16(17)13-3-6-15(7-4-13)25-29(26,27)20-18(22)2-1-9-24-20/h1-12,25H.
What are the key properties of N-[4-[2-chloro-5-(1,3-thiazol-2-yl)phenyl]phenyl]-3-fluoropyridine-2-sulfonamide?
N-[4-[2-chloro-5-(1,3-thiazol-2-yl)phenyl]phenyl]-3-fluoropyridine-2-sulfonamide has a molecular weight of 445.93 g/mol, XLogP of 5.47, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[2-chloro-5-(1,3-thiazol-2-yl)phenyl]phenyl]-3-fluoropyridine-2-sulfonamide is sourced from PubChem (CID 24831422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).