N-[5-(4-chloroanilino)-2-pyridinyl]thiophene-2-sulfonamide

C15H12ClN3O2S2 — CID 113033430

IUPACN-[5-(4-chloroanilino)-2-pyridinyl]thiophene-2-sulfonamide
SMILESO=S(=O)(Nc1ccc(Nc2ccc(Cl)cc2)cn1)c1cccs1
InChIInChI=1S/C15H12ClN3O2S2/c16-11-3-5-12(6-4-11)18-13-7-8-14(17-10-13)19-23(20,21)15-2-1-9-22-15/h1-10,18H,(H,17,19)
InChIKeyHCRBQOKONSJODX-UHFFFAOYSA-N
MW365.87 g/mol
LogP4.34
Rot. Bonds5

About N-[5-(4-chloroanilino)-2-pyridinyl]thiophene-2-sulfonamide

N-[5-(4-chloroanilino)-2-pyridinyl]thiophene-2-sulfonamide (PubChem CID 113033430) has the molecular formula C15H12ClN3O2S2 and a molecular weight of 365.87 g/mol. Its IUPAC name is N-[5-(4-chloroanilino)-2-pyridinyl]thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-[5-(4-chloroanilino)-2-pyridinyl]thiophene-2-sulfonamide
PubChem CID113033430
Molecular FormulaC15H12ClN3O2S2
Molecular Weight365.87 g/mol
Exact Mass365.01
IUPAC NameN-[5-(4-chloroanilino)-2-pyridinyl]thiophene-2-sulfonamide
SMILESO=S(=O)(Nc1ccc(Nc2ccc(Cl)cc2)cn1)c1cccs1
InChIInChI=1S/C15H12ClN3O2S2/c16-11-3-5-12(6-4-11)18-13-7-8-14(17-10-13)19-23(20,21)15-2-1-9-22-15/h1-10,18H,(H,17,19)
InChIKeyHCRBQOKONSJODX-UHFFFAOYSA-N
XLogP4.34
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.87
LogP ≤ 54.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[5-(4-chloroanilino)-2-pyridinyl]thiophene-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

N-[5-(3,4-dimethylanilino)-2-pyridinyl]thiophene-2-sulfonamide
CID 113032152
N-[6-(3-chloro-4-fluoroanilino)-3-pyridinyl]thiophene-2-sulfonamide
CID 113019023
N-[5-(2-chloro-4,6-dimethylanilino)-2-pyridinyl]thiophene-2-sulfonamide
CID 113033745
N-[6-(methylamino)-3-pyridinyl]thiophene-2-sulfonamide
CID 115268517
N-(5-bromo-2-pyridinyl)thiophene-2-sulfonamide
CID 778331
N-[5-[2-(dimethylamino)ethylamino]-2-pyridinyl]thiophene-2-sulfonamide
CID 113025588
N-[6-(3-chloro-4-methylanilino)-3-pyridinyl]thiophene-2-sulfonamide
CID 113018953
N-[5-(4-chloroanilino)-2-pyridinyl]ethanesulfonamide
CID 113033415
N-[6-(3,5-dimethylanilino)-3-pyridinyl]thiophene-2-sulfonamide
CID 113017131
N-[5-[(4-methoxyphenyl)methylamino]-2-pyridinyl]thiophene-2-sulfonamide
CID 113027468
N-[6-(3,4-dimethoxyanilino)-3-pyridinyl]thiophene-2-sulfonamide
CID 113020133
N-[5-[(2-methoxyphenyl)methylamino]-2-pyridinyl]thiophene-2-sulfonamide
CID 113027386

Frequently Asked Questions

What is the IUPAC name of N-[5-(4-chloroanilino)-2-pyridinyl]thiophene-2-sulfonamide?
The IUPAC name of N-[5-(4-chloroanilino)-2-pyridinyl]thiophene-2-sulfonamide (CID 113033430) is N-[5-(4-chloroanilino)-2-pyridinyl]thiophene-2-sulfonamide.
What is the SMILES notation for N-[5-(4-chloroanilino)-2-pyridinyl]thiophene-2-sulfonamide?
The canonical SMILES for N-[5-(4-chloroanilino)-2-pyridinyl]thiophene-2-sulfonamide is O=S(=O)(Nc1ccc(Nc2ccc(Cl)cc2)cn1)c1cccs1.
What is the InChIKey of N-[5-(4-chloroanilino)-2-pyridinyl]thiophene-2-sulfonamide?
The InChIKey is HCRBQOKONSJODX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClN3O2S2/c16-11-3-5-12(6-4-11)18-13-7-8-14(17-10-13)19-23(20,21)15-2-1-9-22-15/h1-10,18H,(H,17,19).
What are the key properties of N-[5-(4-chloroanilino)-2-pyridinyl]thiophene-2-sulfonamide?
N-[5-(4-chloroanilino)-2-pyridinyl]thiophene-2-sulfonamide has a molecular weight of 365.87 g/mol, XLogP of 4.34, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(4-chloroanilino)-2-pyridinyl]thiophene-2-sulfonamide is sourced from PubChem (CID 113033430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).