2-[[(E)-2-(2-chlorophenyl)ethenyl]sulfonylamino]benzenesulfonamide

C14H13ClN2O4S2 — CID 42646765

IUPAC2-[[(E)-2-(2-chlorophenyl)ethenyl]sulfonylamino]benzenesulfonamide
SMILESNS(=O)(=O)c1ccccc1NS(=O)(=O)/C=C/c1ccccc1Cl
InChIInChI=1S/C14H13ClN2O4S2/c15-12-6-2-1-5-11(12)9-10-22(18,19)17-13-7-3-4-8-14(13)23(16,20)21/h1-10,17H,(H2,16,20,21)/b10-9+
InChIKeyPZVACPHKBWKVIP-MDZDMXLPSA-N
MW372.86 g/mol
LogP2.40
Rot. Bonds5

About 2-[[(E)-2-(2-chlorophenyl)ethenyl]sulfonylamino]benzenesulfonamide

2-[[(E)-2-(2-chlorophenyl)ethenyl]sulfonylamino]benzenesulfonamide (PubChem CID 42646765) has the molecular formula C14H13ClN2O4S2 and a molecular weight of 372.86 g/mol. Its IUPAC name is 2-[[(E)-2-(2-chlorophenyl)ethenyl]sulfonylamino]benzenesulfonamide.

Molecular Properties

Compound Name2-[[(E)-2-(2-chlorophenyl)ethenyl]sulfonylamino]benzenesulfonamide
PubChem CID42646765
Molecular FormulaC14H13ClN2O4S2
Molecular Weight372.86 g/mol
Exact Mass372.00
IUPAC Name2-[[(E)-2-(2-chlorophenyl)ethenyl]sulfonylamino]benzenesulfonamide
SMILESNS(=O)(=O)c1ccccc1NS(=O)(=O)/C=C/c1ccccc1Cl
InChIInChI=1S/C14H13ClN2O4S2/c15-12-6-2-1-5-11(12)9-10-22(18,19)17-13-7-3-4-8-14(13)23(16,20)21/h1-10,17H,(H2,16,20,21)/b10-9+
InChIKeyPZVACPHKBWKVIP-MDZDMXLPSA-N
XLogP2.40
TPSA106.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.86
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

Benzenesulfonamide, N-(4-chlorophenyl)-4-methyl-
CID 76182
4-Chloro-4'-ethylbenzenesulfonanilide
CID 710437
2-[(2-Chlorobenzyl)thio]aniline
CID 2818593
N-(5-chloro-2-methylphenyl)benzenesulfonamide
CID 246655
N-(2-Chlorophenyl)-4-methylbenzenesulfonamide
CID 80791
Benzenesulfonamide, N-(4-chloro-3-(trifluoromethyl)phenyl)-4-fluoro-
CID 73141
4-chloro-N-(3-chloro-4-methylphenyl)benzenesulfonamide
CID 295196
4-amino-N-((4-chlorophenyl)methyl)benzene-1-sulfonamide
CID 9150144
2-(4-chlorobenzyl)-1lambda~6~,2,3,4-benzothiatriazine-1,1(2H)-dione
CID 3581717
4-chloro-N-(2-methylphenyl)benzenesulfonamide
CID 722856
N-(3-chloro-4-methylphenyl)-1-phenylmethanesulfonamide
CID 669258
2-chloro-N-(3-cyanophenyl)benzenesulfonamide
CID 7514390

Frequently Asked Questions

What is the IUPAC name of 2-[[(E)-2-(2-chlorophenyl)ethenyl]sulfonylamino]benzenesulfonamide?
The IUPAC name of 2-[[(E)-2-(2-chlorophenyl)ethenyl]sulfonylamino]benzenesulfonamide (CID 42646765) is 2-[[(E)-2-(2-chlorophenyl)ethenyl]sulfonylamino]benzenesulfonamide.
What is the SMILES notation for 2-[[(E)-2-(2-chlorophenyl)ethenyl]sulfonylamino]benzenesulfonamide?
The canonical SMILES for 2-[[(E)-2-(2-chlorophenyl)ethenyl]sulfonylamino]benzenesulfonamide is NS(=O)(=O)c1ccccc1NS(=O)(=O)/C=C/c1ccccc1Cl.
What is the InChIKey of 2-[[(E)-2-(2-chlorophenyl)ethenyl]sulfonylamino]benzenesulfonamide?
The InChIKey is PZVACPHKBWKVIP-MDZDMXLPSA-N. The full InChI is InChI=1S/C14H13ClN2O4S2/c15-12-6-2-1-5-11(12)9-10-22(18,19)17-13-7-3-4-8-14(13)23(16,20)21/h1-10,17H,(H2,16,20,21)/b10-9+.
What are the key properties of 2-[[(E)-2-(2-chlorophenyl)ethenyl]sulfonylamino]benzenesulfonamide?
2-[[(E)-2-(2-chlorophenyl)ethenyl]sulfonylamino]benzenesulfonamide has a molecular weight of 372.86 g/mol, XLogP of 2.40, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(E)-2-(2-chlorophenyl)ethenyl]sulfonylamino]benzenesulfonamide is sourced from PubChem (CID 42646765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).