3,5-dichloro-N-(3-methoxy-2-pyridinyl)benzenesulfonamide

C12H10Cl2N2O3S — CID 154807827

IUPAC3,5-dichloro-N-(3-methoxy-2-pyridinyl)benzenesulfonamide
SMILESCOc1cccnc1NS(=O)(=O)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C12H10Cl2N2O3S/c1-19-11-3-2-4-15-12(11)16-20(17,18)10-6-8(13)5-9(14)7-10/h2-7H,1H3,(H,15,16)
InChIKeyQNBDZWWLXLBWFX-UHFFFAOYSA-N
MW333.20 g/mol
LogP3.20
Rot. Bonds4

About 3,5-dichloro-N-(3-methoxy-2-pyridinyl)benzenesulfonamide

3,5-dichloro-N-(3-methoxy-2-pyridinyl)benzenesulfonamide (PubChem CID 154807827) has the molecular formula C12H10Cl2N2O3S and a molecular weight of 333.20 g/mol. Its IUPAC name is 3,5-dichloro-N-(3-methoxy-2-pyridinyl)benzenesulfonamide.

Molecular Properties

Compound Name3,5-dichloro-N-(3-methoxy-2-pyridinyl)benzenesulfonamide
PubChem CID154807827
Molecular FormulaC12H10Cl2N2O3S
Molecular Weight333.20 g/mol
Exact Mass331.98
IUPAC Name3,5-dichloro-N-(3-methoxy-2-pyridinyl)benzenesulfonamide
SMILESCOc1cccnc1NS(=O)(=O)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C12H10Cl2N2O3S/c1-19-11-3-2-4-15-12(11)16-20(17,18)10-6-8(13)5-9(14)7-10/h2-7H,1H3,(H,15,16)
InChIKeyQNBDZWWLXLBWFX-UHFFFAOYSA-N
XLogP3.20
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.20
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-bromo-N-(3-chloro-2-pyridinyl)-4-methoxybenzenesulfonamide
CID 103943880
3-chloro-N-(3-methyl-2-pyridinyl)benzenesulfonamide
CID 25043050
3,5-dichloro-N-isoquinolin-1-ylbenzenesulfonamide
CID 3792494
4-amino-3-methoxy-N-(3-methyl-2-pyridinyl)benzenesulfonamide
CID 81438403
3-chloro-4-methoxy-N-pyrimidin-2-ylbenzenesulfonamide
CID 110756685
4-amino-N-(3-chloro-2-pyridinyl)-2-methoxybenzenesulfonamide
CID 103093928
N-(5-bromo-3-methoxypyrazin-2-yl)-3,5-dichlorobenzenesulfonamide
CID 10309892
4-chloro-N-(3-chloro-2-pyridinyl)benzenesulfonamide
CID 103886271
N-[3-[(3,4-dichlorophenyl)methoxy]-2-pyridinyl]-4-methylbenzenesulfonamide
CID 2728379
3,5-dichloro-N-pyridin-3-ylbenzenesulfonamide
CID 3269893
3,5-dichloro-N-(4-methoxy-5,6,7,8-tetrahydronaphthalen-1-yl)benzenesulfonamide
CID 143337884
4-chloro-3-methoxy-N-pyridin-2-ylbenzenesulfonamide
CID 674105

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-N-(3-methoxy-2-pyridinyl)benzenesulfonamide?
The IUPAC name of 3,5-dichloro-N-(3-methoxy-2-pyridinyl)benzenesulfonamide (CID 154807827) is 3,5-dichloro-N-(3-methoxy-2-pyridinyl)benzenesulfonamide.
What is the SMILES notation for 3,5-dichloro-N-(3-methoxy-2-pyridinyl)benzenesulfonamide?
The canonical SMILES for 3,5-dichloro-N-(3-methoxy-2-pyridinyl)benzenesulfonamide is COc1cccnc1NS(=O)(=O)c1cc(Cl)cc(Cl)c1.
What is the InChIKey of 3,5-dichloro-N-(3-methoxy-2-pyridinyl)benzenesulfonamide?
The InChIKey is QNBDZWWLXLBWFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10Cl2N2O3S/c1-19-11-3-2-4-15-12(11)16-20(17,18)10-6-8(13)5-9(14)7-10/h2-7H,1H3,(H,15,16).
What are the key properties of 3,5-dichloro-N-(3-methoxy-2-pyridinyl)benzenesulfonamide?
3,5-dichloro-N-(3-methoxy-2-pyridinyl)benzenesulfonamide has a molecular weight of 333.20 g/mol, XLogP of 3.20, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-N-(3-methoxy-2-pyridinyl)benzenesulfonamide is sourced from PubChem (CID 154807827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).