N-[1-(4-sulfamoylphenyl)ethyl]-4-(1,3-thiazol-4-ylmethoxy)benzamide

C19H19N3O4S2 — CID 45281533

IUPACN-[1-(4-sulfamoylphenyl)ethyl]-4-(1,3-thiazol-4-ylmethoxy)benzamide
SMILESCC(NC(=O)c1ccc(OCc2cscn2)cc1)c1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C19H19N3O4S2/c1-13(14-4-8-18(9-5-14)28(20,24)25)22-19(23)15-2-6-17(7-3-15)26-10-16-11-27-12-21-16/h2-9,11-13H,10H2,1H3,(H,22,23)(H2,20,24,25)
InChIKeyZGDIUOUDWAZLKH-UHFFFAOYSA-N
MW417.51 g/mol
LogP2.86
Rot. Bonds7

About N-[1-(4-sulfamoylphenyl)ethyl]-4-(1,3-thiazol-4-ylmethoxy)benzamide

N-[1-(4-sulfamoylphenyl)ethyl]-4-(1,3-thiazol-4-ylmethoxy)benzamide (PubChem CID 45281533) has the molecular formula C19H19N3O4S2 and a molecular weight of 417.51 g/mol. Its IUPAC name is N-[1-(4-sulfamoylphenyl)ethyl]-4-(1,3-thiazol-4-ylmethoxy)benzamide.

Molecular Properties

Compound NameN-[1-(4-sulfamoylphenyl)ethyl]-4-(1,3-thiazol-4-ylmethoxy)benzamide
PubChem CID45281533
Molecular FormulaC19H19N3O4S2
Molecular Weight417.51 g/mol
Exact Mass417.08
IUPAC NameN-[1-(4-sulfamoylphenyl)ethyl]-4-(1,3-thiazol-4-ylmethoxy)benzamide
SMILESCC(NC(=O)c1ccc(OCc2cscn2)cc1)c1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C19H19N3O4S2/c1-13(14-4-8-18(9-5-14)28(20,24)25)22-19(23)15-2-6-17(7-3-15)26-10-16-11-27-12-21-16/h2-9,11-13H,10H2,1H3,(H,22,23)(H2,20,24,25)
InChIKeyZGDIUOUDWAZLKH-UHFFFAOYSA-N
XLogP2.86
TPSA111.38 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500417.51
LogP ≤ 52.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-[1-(4-sulfamoylphenyl)ethyl]-4-(1,3-thiazol-4-ylmethoxy)benzamide 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

1-[1-(4-sulfamoylphenyl)ethyl]-3-[3-(1,3-thiazol-4-ylmethoxy)phenyl]urea
CID 56567767
N-[1-(4-ethoxyphenyl)ethyl]-4-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzamide
CID 55473945
4-oxo-4-(4-propoxyphenyl)-N-[(1S)-1-(4-sulfamoylphenyl)ethyl]butanamide
CID 41041234
N-[1-(4-ethoxyphenyl)ethyl]-4-propan-2-ylsulfonylbenzamide
CID 55759452
4-[(2-chlorophenyl)methoxy]-N-[1-(4-methylsulfonylphenyl)ethyl]benzamide
CID 133165582
N-(1-hydroxy-2-methylpropan-2-yl)-4-(1,3-thiazol-4-ylmethoxy)benzamide
CID 110000901
4-(pyridin-4-ylsulfamoyl)-N-[1-(4-sulfamoylphenyl)ethyl]benzamide
CID 55616707
N-[1-(4-ethoxyphenyl)ethyl]-4-[methyl(propan-2-yl)sulfamoyl]benzamide
CID 55490961
4-(phenylsulfamoyl)-N-[(1S)-1-(4-sulfamoylphenyl)ethyl]benzamide
CID 2446308
4-(phenylsulfamoyl)-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]benzamide
CID 2446305
2-(4-ethoxyphenyl)sulfanyl-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]acetamide
CID 41095805
N-(2-hydroxy-2,3-dimethylpentyl)-4-(1,3-thiazol-4-ylmethoxy)benzamide
CID 111477987

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-sulfamoylphenyl)ethyl]-4-(1,3-thiazol-4-ylmethoxy)benzamide?
The IUPAC name of N-[1-(4-sulfamoylphenyl)ethyl]-4-(1,3-thiazol-4-ylmethoxy)benzamide (CID 45281533) is N-[1-(4-sulfamoylphenyl)ethyl]-4-(1,3-thiazol-4-ylmethoxy)benzamide.
What is the SMILES notation for N-[1-(4-sulfamoylphenyl)ethyl]-4-(1,3-thiazol-4-ylmethoxy)benzamide?
The canonical SMILES for N-[1-(4-sulfamoylphenyl)ethyl]-4-(1,3-thiazol-4-ylmethoxy)benzamide is CC(NC(=O)c1ccc(OCc2cscn2)cc1)c1ccc(S(N)(=O)=O)cc1.
What is the InChIKey of N-[1-(4-sulfamoylphenyl)ethyl]-4-(1,3-thiazol-4-ylmethoxy)benzamide?
The InChIKey is ZGDIUOUDWAZLKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O4S2/c1-13(14-4-8-18(9-5-14)28(20,24)25)22-19(23)15-2-6-17(7-3-15)26-10-16-11-27-12-21-16/h2-9,11-13H,10H2,1H3,(H,22,23)(H2,20,24,25).
What are the key properties of N-[1-(4-sulfamoylphenyl)ethyl]-4-(1,3-thiazol-4-ylmethoxy)benzamide?
N-[1-(4-sulfamoylphenyl)ethyl]-4-(1,3-thiazol-4-ylmethoxy)benzamide has a molecular weight of 417.51 g/mol, XLogP of 2.86, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-sulfamoylphenyl)ethyl]-4-(1,3-thiazol-4-ylmethoxy)benzamide is sourced from PubChem (CID 45281533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).