5-bromo-N-(6-phenyl-3-pyridinyl)thiophene-2-sulfonamide

C15H11BrN2O2S2 — CID 110634801

IUPAC5-bromo-N-(6-phenyl-3-pyridinyl)thiophene-2-sulfonamide
SMILESO=S(=O)(Nc1ccc(-c2ccccc2)nc1)c1ccc(Br)s1
InChIInChI=1S/C15H11BrN2O2S2/c16-14-8-9-15(21-14)22(19,20)18-12-6-7-13(17-10-12)11-4-2-1-3-5-11/h1-10,18H
InChIKeyGINZJJOQXGGMHN-UHFFFAOYSA-N
MW395.30 g/mol
LogP4.37
Rot. Bonds4

About 5-bromo-N-(6-phenyl-3-pyridinyl)thiophene-2-sulfonamide

5-bromo-N-(6-phenyl-3-pyridinyl)thiophene-2-sulfonamide (PubChem CID 110634801) has the molecular formula C15H11BrN2O2S2 and a molecular weight of 395.30 g/mol. Its IUPAC name is 5-bromo-N-(6-phenyl-3-pyridinyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-bromo-N-(6-phenyl-3-pyridinyl)thiophene-2-sulfonamide
PubChem CID110634801
Molecular FormulaC15H11BrN2O2S2
Molecular Weight395.30 g/mol
Exact Mass393.94
IUPAC Name5-bromo-N-(6-phenyl-3-pyridinyl)thiophene-2-sulfonamide
SMILESO=S(=O)(Nc1ccc(-c2ccccc2)nc1)c1ccc(Br)s1
InChIInChI=1S/C15H11BrN2O2S2/c16-14-8-9-15(21-14)22(19,20)18-12-6-7-13(17-10-12)11-4-2-1-3-5-11/h1-10,18H
InChIKeyGINZJJOQXGGMHN-UHFFFAOYSA-N
XLogP4.37
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.30
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(6-amino-3-pyridinyl)-5-bromothiophene-2-sulfonamide
CID 60790488
2-[5-[(5-bromothiophen-2-yl)sulfonylamino]-2-pyridinyl]acetic acid
CID 107339698
N-(6-phenyl-3-pyridinyl)ethanesulfonamide
CID 110634770
N-(4-aminophenyl)-5-bromothiophene-2-sulfonamide
CID 43166676
5-bromo-N-[4-(methanesulfonamido)phenyl]thiophene-2-sulfonamide
CID 31073677
N-[5-[(6-phenyl-3-pyridinyl)sulfamoyl]-1,3,4-thiadiazol-2-yl]acetamide
CID 110634809
5-bromo-N-[6-(2-methoxyethylamino)-3-pyridinyl]thiophene-2-sulfonamide
CID 113010432
5-bromo-N-(4-tert-butylphenyl)thiophene-2-sulfonamide
CID 3559353
5-bromo-N-[4-[(4-bromophenyl)sulfamoyl]phenyl]thiophene-2-sulfonamide
CID 22193739
5-bromo-N-[4-(chloromethyl)phenyl]thiophene-2-sulfonamide
CID 65031324
5-[(5-bromothiophen-2-yl)sulfonylamino]-2-(dimethylamino)pyridine-3-carboxylic acid
CID 53024854
3,4-dimethoxy-N-(6-phenyl-3-pyridinyl)benzenesulfonamide
CID 110406353

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(6-phenyl-3-pyridinyl)thiophene-2-sulfonamide?
The IUPAC name of 5-bromo-N-(6-phenyl-3-pyridinyl)thiophene-2-sulfonamide (CID 110634801) is 5-bromo-N-(6-phenyl-3-pyridinyl)thiophene-2-sulfonamide.
What is the SMILES notation for 5-bromo-N-(6-phenyl-3-pyridinyl)thiophene-2-sulfonamide?
The canonical SMILES for 5-bromo-N-(6-phenyl-3-pyridinyl)thiophene-2-sulfonamide is O=S(=O)(Nc1ccc(-c2ccccc2)nc1)c1ccc(Br)s1.
What is the InChIKey of 5-bromo-N-(6-phenyl-3-pyridinyl)thiophene-2-sulfonamide?
The InChIKey is GINZJJOQXGGMHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11BrN2O2S2/c16-14-8-9-15(21-14)22(19,20)18-12-6-7-13(17-10-12)11-4-2-1-3-5-11/h1-10,18H.
What are the key properties of 5-bromo-N-(6-phenyl-3-pyridinyl)thiophene-2-sulfonamide?
5-bromo-N-(6-phenyl-3-pyridinyl)thiophene-2-sulfonamide has a molecular weight of 395.30 g/mol, XLogP of 4.37, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(6-phenyl-3-pyridinyl)thiophene-2-sulfonamide is sourced from PubChem (CID 110634801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).