5-(aminomethyl)-2-bromo-N-(3-bromo-2-pyridinyl)furan-3-sulfonamide

C10H9Br2N3O3S — CID 106062158

IUPAC5-(aminomethyl)-2-bromo-N-(3-bromo-2-pyridinyl)furan-3-sulfonamide
SMILESNCc1cc(S(=O)(=O)Nc2ncccc2Br)c(Br)o1
InChIInChI=1S/C10H9Br2N3O3S/c11-7-2-1-3-14-10(7)15-19(16,17)8-4-6(5-13)18-9(8)12/h1-4H,5,13H2,(H,14,15)
InChIKeyBVWGLYARKFWFOR-UHFFFAOYSA-N
MW411.08 g/mol
LogP2.46
Rot. Bonds4

About 5-(aminomethyl)-2-bromo-N-(3-bromo-2-pyridinyl)furan-3-sulfonamide

5-(aminomethyl)-2-bromo-N-(3-bromo-2-pyridinyl)furan-3-sulfonamide (PubChem CID 106062158) has the molecular formula C10H9Br2N3O3S and a molecular weight of 411.08 g/mol. Its IUPAC name is 5-(aminomethyl)-2-bromo-N-(3-bromo-2-pyridinyl)furan-3-sulfonamide.

Molecular Properties

Compound Name5-(aminomethyl)-2-bromo-N-(3-bromo-2-pyridinyl)furan-3-sulfonamide
PubChem CID106062158
Molecular FormulaC10H9Br2N3O3S
Molecular Weight411.08 g/mol
Exact Mass408.87
IUPAC Name5-(aminomethyl)-2-bromo-N-(3-bromo-2-pyridinyl)furan-3-sulfonamide
SMILESNCc1cc(S(=O)(=O)Nc2ncccc2Br)c(Br)o1
InChIInChI=1S/C10H9Br2N3O3S/c11-7-2-1-3-14-10(7)15-19(16,17)8-4-6(5-13)18-9(8)12/h1-4H,5,13H2,(H,14,15)
InChIKeyBVWGLYARKFWFOR-UHFFFAOYSA-N
XLogP2.46
TPSA98.22 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500411.08
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-amino-4-bromo-N-(3-bromo-2-pyridinyl)-2-fluorobenzenesulfonamide
CID 116530437
2-bromo-N-(3-chloro-2-pyridinyl)-5-(ethylaminomethyl)furan-3-sulfonamide
CID 106086603
5-(aminomethyl)-2-bromo-N',N'-dimethylfuran-3-sulfonohydrazide
CID 106074764
4-(aminomethyl)-N-(3-bromo-2-pyridinyl)-3-chlorobenzenesulfonamide
CID 106062257
5-(aminomethyl)-2-bromo-N-(2-ethoxyphenyl)furan-3-sulfonamide
CID 106048841
5-(aminomethyl)-2-bromo-N-(2-bromo-5-chloro-4-methylphenyl)furan-3-sulfonamide
CID 106078945
5-(aminomethyl)-2-bromo-N-[2-(dimethylamino)phenyl]furan-3-sulfonamide
CID 106005665
1-[4-(aminomethyl)phenyl]-N-(3-bromo-2-pyridinyl)methanesulfonamide
CID 106062175
5-(aminomethyl)-2-bromo-N-(2,6-dichloro-4-fluorophenyl)furan-3-sulfonamide
CID 106075609
5-(aminomethyl)-2-bromo-N-(5-chloro-2-fluorophenyl)furan-3-sulfonamide
CID 106030356
5-(aminomethyl)-2-bromo-N-(2,5-dichlorophenyl)furan-3-sulfonamide
CID 106037280
4-amino-N-(3-bromo-2-pyridinyl)-3-fluorobenzenesulfonamide
CID 82843664

Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-2-bromo-N-(3-bromo-2-pyridinyl)furan-3-sulfonamide?
The IUPAC name of 5-(aminomethyl)-2-bromo-N-(3-bromo-2-pyridinyl)furan-3-sulfonamide (CID 106062158) is 5-(aminomethyl)-2-bromo-N-(3-bromo-2-pyridinyl)furan-3-sulfonamide.
What is the SMILES notation for 5-(aminomethyl)-2-bromo-N-(3-bromo-2-pyridinyl)furan-3-sulfonamide?
The canonical SMILES for 5-(aminomethyl)-2-bromo-N-(3-bromo-2-pyridinyl)furan-3-sulfonamide is NCc1cc(S(=O)(=O)Nc2ncccc2Br)c(Br)o1.
What is the InChIKey of 5-(aminomethyl)-2-bromo-N-(3-bromo-2-pyridinyl)furan-3-sulfonamide?
The InChIKey is BVWGLYARKFWFOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9Br2N3O3S/c11-7-2-1-3-14-10(7)15-19(16,17)8-4-6(5-13)18-9(8)12/h1-4H,5,13H2,(H,14,15).
What are the key properties of 5-(aminomethyl)-2-bromo-N-(3-bromo-2-pyridinyl)furan-3-sulfonamide?
5-(aminomethyl)-2-bromo-N-(3-bromo-2-pyridinyl)furan-3-sulfonamide has a molecular weight of 411.08 g/mol, XLogP of 2.46, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-2-bromo-N-(3-bromo-2-pyridinyl)furan-3-sulfonamide is sourced from PubChem (CID 106062158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).