4-[2-(thieno[3,2-b]pyridin-7-ylamino)ethyl]benzenesulfonamide

C15H15N3O2S2 — CID 71871497

IUPAC4-[2-(thieno[3,2-b]pyridin-7-ylamino)ethyl]benzenesulfonamide
SMILESNS(=O)(=O)c1ccc(CCNc2ccnc3ccsc23)cc1
InChIInChI=1S/C15H15N3O2S2/c16-22(19,20)12-3-1-11(2-4-12)5-8-17-13-6-9-18-14-7-10-21-15(13)14/h1-4,6-7,9-10H,5,8H2,(H,17,18)(H2,16,19,20)
InChIKeyVJCIBJMSUIIDEA-UHFFFAOYSA-N
MW333.44 g/mol
LogP2.60
Rot. Bonds5

About 4-[2-(thieno[3,2-b]pyridin-7-ylamino)ethyl]benzenesulfonamide

4-[2-(thieno[3,2-b]pyridin-7-ylamino)ethyl]benzenesulfonamide (PubChem CID 71871497) has the molecular formula C15H15N3O2S2 and a molecular weight of 333.44 g/mol. Its IUPAC name is 4-[2-(thieno[3,2-b]pyridin-7-ylamino)ethyl]benzenesulfonamide.

Molecular Properties

Compound Name4-[2-(thieno[3,2-b]pyridin-7-ylamino)ethyl]benzenesulfonamide
PubChem CID71871497
Molecular FormulaC15H15N3O2S2
Molecular Weight333.44 g/mol
Exact Mass333.06
IUPAC Name4-[2-(thieno[3,2-b]pyridin-7-ylamino)ethyl]benzenesulfonamide
SMILESNS(=O)(=O)c1ccc(CCNc2ccnc3ccsc23)cc1
InChIInChI=1S/C15H15N3O2S2/c16-22(19,20)12-3-1-11(2-4-12)5-8-17-13-6-9-18-14-7-10-21-15(13)14/h1-4,6-7,9-10H,5,8H2,(H,17,18)(H2,16,19,20)
InChIKeyVJCIBJMSUIIDEA-UHFFFAOYSA-N
XLogP2.60
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.44
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-[2-(thieno[3,2-b]pyridin-7-ylamino)ethyl]benzenesulfonamide 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

4-[2-(4-oxothieno[3,2-d]pyrimidin-3-yl)ethyl]benzenesulfonamide
CID 39796767
4-[2-[(4-pyridin-2-ylpyrimidin-2-yl)amino]ethyl]benzenesulfonamide
CID 72844304
4-[2-[[4-(butylamino)pyrimidin-2-yl]amino]ethyl]benzenesulfonamide
CID 112882844
4-[2-[[2-(butylamino)pyrimidin-4-yl]amino]ethyl]benzenesulfonamide
CID 112883036
4-[2-(imidazo[2,1-b][1,3,4]thiadiazol-2-ylamino)ethyl]benzenesulfonamide
CID 58285847
4-amino-3-(2-pyridin-4-ylethylamino)benzenesulfonamide
CID 82907842
4-[2-[(3-cyanopyrazin-2-yl)amino]ethyl]benzenesulfonamide
CID 60620125
(2R)-1-(thieno[3,2-b]pyridin-7-ylamino)propan-2-ol
CID 130653771
N-[2-(2-methylprop-2-enoxy)ethyl]thieno[3,2-b]pyridin-7-amine
CID 133366334
4-[2-(4,5-dihydro-1,3-thiazol-2-ylamino)ethyl]benzenesulfonamide
CID 54995967
4-[2-[[6-(2-phenylethylamino)pyrimidin-4-yl]amino]ethyl]benzenesulfonamide
CID 112861041
4-[2-[(7-methylpurin-2-yl)amino]ethyl]benzenesulfonamide
CID 157016797

Frequently Asked Questions

What is the IUPAC name of 4-[2-(thieno[3,2-b]pyridin-7-ylamino)ethyl]benzenesulfonamide?
The IUPAC name of 4-[2-(thieno[3,2-b]pyridin-7-ylamino)ethyl]benzenesulfonamide (CID 71871497) is 4-[2-(thieno[3,2-b]pyridin-7-ylamino)ethyl]benzenesulfonamide.
What is the SMILES notation for 4-[2-(thieno[3,2-b]pyridin-7-ylamino)ethyl]benzenesulfonamide?
The canonical SMILES for 4-[2-(thieno[3,2-b]pyridin-7-ylamino)ethyl]benzenesulfonamide is NS(=O)(=O)c1ccc(CCNc2ccnc3ccsc23)cc1.
What is the InChIKey of 4-[2-(thieno[3,2-b]pyridin-7-ylamino)ethyl]benzenesulfonamide?
The InChIKey is VJCIBJMSUIIDEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O2S2/c16-22(19,20)12-3-1-11(2-4-12)5-8-17-13-6-9-18-14-7-10-21-15(13)14/h1-4,6-7,9-10H,5,8H2,(H,17,18)(H2,16,19,20).
What are the key properties of 4-[2-(thieno[3,2-b]pyridin-7-ylamino)ethyl]benzenesulfonamide?
4-[2-(thieno[3,2-b]pyridin-7-ylamino)ethyl]benzenesulfonamide has a molecular weight of 333.44 g/mol, XLogP of 2.60, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(thieno[3,2-b]pyridin-7-ylamino)ethyl]benzenesulfonamide is sourced from PubChem (CID 71871497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).