2-(4-chlorophenyl)sulfonylnaphthalene

C16H11ClO2S — CID 2506576

IUPAC2-(4-chlorophenyl)sulfonylnaphthalene
SMILESO=S(=O)(c1ccc(Cl)cc1)c1ccc2ccccc2c1
InChIInChI=1S/C16H11ClO2S/c17-14-6-9-15(10-7-14)20(18,19)16-8-5-12-3-1-2-4-13(12)11-16/h1-11H
InChIKeyGXGCJXNHQRVNAH-UHFFFAOYSA-N
MW302.78 g/mol
LogP4.33
Rot. Bonds2

About 2-(4-chlorophenyl)sulfonylnaphthalene

2-(4-chlorophenyl)sulfonylnaphthalene (PubChem CID 2506576) has the molecular formula C16H11ClO2S and a molecular weight of 302.78 g/mol. Its IUPAC name is 2-(4-chlorophenyl)sulfonylnaphthalene.

Molecular Properties

Compound Name2-(4-chlorophenyl)sulfonylnaphthalene
PubChem CID2506576
Molecular FormulaC16H11ClO2S
Molecular Weight302.78 g/mol
Exact Mass302.02
IUPAC Name2-(4-chlorophenyl)sulfonylnaphthalene
SMILESO=S(=O)(c1ccc(Cl)cc1)c1ccc2ccccc2c1
InChIInChI=1S/C16H11ClO2S/c17-14-6-9-15(10-7-14)20(18,19)16-8-5-12-3-1-2-4-13(12)11-16/h1-11H
InChIKeyGXGCJXNHQRVNAH-UHFFFAOYSA-N
XLogP4.33
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.78
LogP ≤ 54.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[4-(bromomethyl)phenyl]sulfonylnaphthalene
CID 54331291
2-[4-[(4-methylphenyl)methyl]phenyl]sulfonylnaphthalene
CID 54552474
2-(4-chlorophenyl)sulfonylquinoline
CID 122229120
2-chloronaphthalene;naphthalene
CID 159169098
naphthalene-2-sulfonic acid
CID 8420
N-(4-chloro-2-methylphenyl)-N-methylnaphthalene-2-sulfonamide
CID 100532875
4-(benzenesulfonyl)-2-(4-chlorophenyl)sulfonylphenol
CID 19710946
4-chloro-N-[4-[(4-chlorobenzoyl)-naphthalen-2-ylsulfonylamino]phenyl]-N-naphthalen-2-ylsulfonylbenzamide
CID 3436129
CID 87246277
CID 87246277
naphthalene-2-sulfonic acid;zinc
CID 87263273
CID 88530425
CID 88530425
3-(4-chlorophenyl)sulfonylbenzaldehyde
CID 87544782

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)sulfonylnaphthalene?
The IUPAC name of 2-(4-chlorophenyl)sulfonylnaphthalene (CID 2506576) is 2-(4-chlorophenyl)sulfonylnaphthalene.
What is the SMILES notation for 2-(4-chlorophenyl)sulfonylnaphthalene?
The canonical SMILES for 2-(4-chlorophenyl)sulfonylnaphthalene is O=S(=O)(c1ccc(Cl)cc1)c1ccc2ccccc2c1.
What is the InChIKey of 2-(4-chlorophenyl)sulfonylnaphthalene?
The InChIKey is GXGCJXNHQRVNAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11ClO2S/c17-14-6-9-15(10-7-14)20(18,19)16-8-5-12-3-1-2-4-13(12)11-16/h1-11H.
What are the key properties of 2-(4-chlorophenyl)sulfonylnaphthalene?
2-(4-chlorophenyl)sulfonylnaphthalene has a molecular weight of 302.78 g/mol, XLogP of 4.33, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)sulfonylnaphthalene is sourced from PubChem (CID 2506576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).