3-(3-chlorophenyl)sulfonyl-6-methoxypyridazine

C11H9ClN2O3S — CID 11637775

IUPAC3-(3-chlorophenyl)sulfonyl-6-methoxypyridazine
SMILESCOc1ccc(S(=O)(=O)c2cccc(Cl)c2)nn1
InChIInChI=1S/C11H9ClN2O3S/c1-17-10-5-6-11(14-13-10)18(15,16)9-4-2-3-8(12)7-9/h2-7H,1H3
InChIKeyVGIQMJWDNYWNEV-UHFFFAOYSA-N
MW284.72 g/mol
LogP1.97
Rot. Bonds3

About 3-(3-chlorophenyl)sulfonyl-6-methoxypyridazine

3-(3-chlorophenyl)sulfonyl-6-methoxypyridazine (PubChem CID 11637775) has the molecular formula C11H9ClN2O3S and a molecular weight of 284.72 g/mol. Its IUPAC name is 3-(3-chlorophenyl)sulfonyl-6-methoxypyridazine.

Molecular Properties

Compound Name3-(3-chlorophenyl)sulfonyl-6-methoxypyridazine
PubChem CID11637775
Molecular FormulaC11H9ClN2O3S
Molecular Weight284.72 g/mol
Exact Mass284.00
IUPAC Name3-(3-chlorophenyl)sulfonyl-6-methoxypyridazine
SMILESCOc1ccc(S(=O)(=O)c2cccc(Cl)c2)nn1
InChIInChI=1S/C11H9ClN2O3S/c1-17-10-5-6-11(14-13-10)18(15,16)9-4-2-3-8(12)7-9/h2-7H,1H3
InChIKeyVGIQMJWDNYWNEV-UHFFFAOYSA-N
XLogP1.97
TPSA69.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.72
LogP ≤ 51.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

3-(3-chlorophenyl)sulfonyl-N-(6-methoxy-3-pyridinyl)propanamide
CID 110620805
5-(3-chlorophenyl)sulfonylpyrimidin-2-amine
CID 82305723
1-chloro-3-ethenylsulfonylbenzene
CID 62950197
bis(3-chlorobenzenesulfonate);mercury(2+)
CID 22604170
3-chloro-N-(3-chlorophenyl)sulfonylbenzenesulfonamide
CID 18537457
potassium 3-chlorobenzenesulfonamide
CID 19353487
1-chloro-3-(1-chloroethylsulfonyl)benzene
CID 173357719
3-chloro-N,N-dimethylbenzenesulfonamide;hydrochloride
CID 142417239
(3-chlorophenyl)-ethyl-imino-oxo-λ6-sulfane
CID 134690739
3-(3-methoxyphenyl)sulfonyl-1H-pyridazin-6-one
CID 46507902
3-chloro-N-[2-(3,4-dimethoxyphenyl)propan-2-yl]benzenesulfonamide
CID 113091569
3-(2,6-dimethoxyphenyl)benzenesulfonic acid
CID 87742445

Frequently Asked Questions

What is the IUPAC name of 3-(3-chlorophenyl)sulfonyl-6-methoxypyridazine?
The IUPAC name of 3-(3-chlorophenyl)sulfonyl-6-methoxypyridazine (CID 11637775) is 3-(3-chlorophenyl)sulfonyl-6-methoxypyridazine.
What is the SMILES notation for 3-(3-chlorophenyl)sulfonyl-6-methoxypyridazine?
The canonical SMILES for 3-(3-chlorophenyl)sulfonyl-6-methoxypyridazine is COc1ccc(S(=O)(=O)c2cccc(Cl)c2)nn1.
What is the InChIKey of 3-(3-chlorophenyl)sulfonyl-6-methoxypyridazine?
The InChIKey is VGIQMJWDNYWNEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9ClN2O3S/c1-17-10-5-6-11(14-13-10)18(15,16)9-4-2-3-8(12)7-9/h2-7H,1H3.
What are the key properties of 3-(3-chlorophenyl)sulfonyl-6-methoxypyridazine?
3-(3-chlorophenyl)sulfonyl-6-methoxypyridazine has a molecular weight of 284.72 g/mol, XLogP of 1.97, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-chlorophenyl)sulfonyl-6-methoxypyridazine is sourced from PubChem (CID 11637775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).