5-bromo-4-chloro-N-[(2R)-2-hydroxypropyl]thiophene-2-sulfonamide

C7H9BrClNO3S2 — CID 83030123

IUPAC5-bromo-4-chloro-N-[(2R)-2-hydroxypropyl]thiophene-2-sulfonamide
SMILESC[C@@H](O)CNS(=O)(=O)c1cc(Cl)c(Br)s1
InChIInChI=1S/C7H9BrClNO3S2/c1-4(11)3-10-15(12,13)6-2-5(9)7(8)14-6/h2,4,10-11H,3H2,1H3/t4-/m1/s1
InChIKeyHFXVTTNSACOFHP-SCSAIBSYSA-N
MW334.64 g/mol
LogP1.82
Rot. Bonds4

About 5-bromo-4-chloro-N-[(2R)-2-hydroxypropyl]thiophene-2-sulfonamide

5-bromo-4-chloro-N-[(2R)-2-hydroxypropyl]thiophene-2-sulfonamide (PubChem CID 83030123) has the molecular formula C7H9BrClNO3S2 and a molecular weight of 334.64 g/mol. Its IUPAC name is 5-bromo-4-chloro-N-[(2R)-2-hydroxypropyl]thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-bromo-4-chloro-N-[(2R)-2-hydroxypropyl]thiophene-2-sulfonamide
PubChem CID83030123
Molecular FormulaC7H9BrClNO3S2
Molecular Weight334.64 g/mol
Exact Mass332.89
IUPAC Name5-bromo-4-chloro-N-[(2R)-2-hydroxypropyl]thiophene-2-sulfonamide
SMILESC[C@@H](O)CNS(=O)(=O)c1cc(Cl)c(Br)s1
InChIInChI=1S/C7H9BrClNO3S2/c1-4(11)3-10-15(12,13)6-2-5(9)7(8)14-6/h2,4,10-11H,3H2,1H3/t4-/m1/s1
InChIKeyHFXVTTNSACOFHP-SCSAIBSYSA-N
XLogP1.82
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.64
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-bromo-4-chloro-N-[(2R)-2-hydroxypropyl]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

5-bromo-4-chloro-N-[2-methyl-3-(methylamino)propyl]thiophene-2-sulfonamide
CID 115302757
2-[[(5-bromo-4-chlorothiophen-2-yl)sulfonylamino]methyl]-3-methylbutanoic acid
CID 80577423
5-bromo-4-chloro-N-(2-cyclopropyl-2-hydroxyethyl)thiophene-2-sulfonamide
CID 80577895
methyl 3-[(5-bromo-4-chlorothiophen-2-yl)sulfonylamino]-2-chloropropanoate
CID 103493476
5-bromo-4-chloro-N-(1-hydroxypropan-2-yl)thiophene-2-sulfonamide
CID 80577968
(2S)-4-[(5-bromo-4-chlorothiophen-2-yl)sulfonylamino]-2-hydroxybutanoic acid
CID 104934085
N-(1-aminopropan-2-yl)-5-bromo-4-chlorothiophene-2-sulfonamide
CID 80577776
5-bromo-4-chloro-N-(2-hydroxy-2-methylbutyl)thiophene-2-sulfonamide
CID 80578090
5-bromo-4-chloro-N-(2-methylpentan-3-yl)thiophene-2-sulfonamide
CID 80580103
N-(5-bromo-4-chlorothiophen-2-yl)sulfonylacetamide
CID 80580140
5-bromo-N-(4-bromobutyl)-4-chlorothiophene-2-sulfonamide
CID 106846697
(2R)-2-[(5-bromo-4-chlorothiophen-2-yl)sulfonylamino]butanoic acid
CID 80577604

Frequently Asked Questions

What is the IUPAC name of 5-bromo-4-chloro-N-[(2R)-2-hydroxypropyl]thiophene-2-sulfonamide?
The IUPAC name of 5-bromo-4-chloro-N-[(2R)-2-hydroxypropyl]thiophene-2-sulfonamide (CID 83030123) is 5-bromo-4-chloro-N-[(2R)-2-hydroxypropyl]thiophene-2-sulfonamide.
What is the SMILES notation for 5-bromo-4-chloro-N-[(2R)-2-hydroxypropyl]thiophene-2-sulfonamide?
The canonical SMILES for 5-bromo-4-chloro-N-[(2R)-2-hydroxypropyl]thiophene-2-sulfonamide is C[C@@H](O)CNS(=O)(=O)c1cc(Cl)c(Br)s1.
What is the InChIKey of 5-bromo-4-chloro-N-[(2R)-2-hydroxypropyl]thiophene-2-sulfonamide?
The InChIKey is HFXVTTNSACOFHP-SCSAIBSYSA-N. The full InChI is InChI=1S/C7H9BrClNO3S2/c1-4(11)3-10-15(12,13)6-2-5(9)7(8)14-6/h2,4,10-11H,3H2,1H3/t4-/m1/s1.
What are the key properties of 5-bromo-4-chloro-N-[(2R)-2-hydroxypropyl]thiophene-2-sulfonamide?
5-bromo-4-chloro-N-[(2R)-2-hydroxypropyl]thiophene-2-sulfonamide has a molecular weight of 334.64 g/mol, XLogP of 1.82, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-4-chloro-N-[(2R)-2-hydroxypropyl]thiophene-2-sulfonamide is sourced from PubChem (CID 83030123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).