2-chloro-5-[(4-ethoxyphenyl)sulfonylamino]benzamide

C15H15ClN2O4S — CID 35546601

IUPAC2-chloro-5-[(4-ethoxyphenyl)sulfonylamino]benzamide
SMILESCCOc1ccc(S(=O)(=O)Nc2ccc(Cl)c(C(N)=O)c2)cc1
InChIInChI=1S/C15H15ClN2O4S/c1-2-22-11-4-6-12(7-5-11)23(20,21)18-10-3-8-14(16)13(9-10)15(17)19/h3-9,18H,2H2,1H3,(H2,17,19)
InChIKeyWYUKEYQXTXRCSM-UHFFFAOYSA-N
MW354.82 g/mol
LogP2.64
Rot. Bonds6

About 2-chloro-5-[(4-ethoxyphenyl)sulfonylamino]benzamide

2-chloro-5-[(4-ethoxyphenyl)sulfonylamino]benzamide (PubChem CID 35546601) has the molecular formula C15H15ClN2O4S and a molecular weight of 354.82 g/mol. Its IUPAC name is 2-chloro-5-[(4-ethoxyphenyl)sulfonylamino]benzamide.

Molecular Properties

Compound Name2-chloro-5-[(4-ethoxyphenyl)sulfonylamino]benzamide
PubChem CID35546601
Molecular FormulaC15H15ClN2O4S
Molecular Weight354.82 g/mol
Exact Mass354.04
IUPAC Name2-chloro-5-[(4-ethoxyphenyl)sulfonylamino]benzamide
SMILESCCOc1ccc(S(=O)(=O)Nc2ccc(Cl)c(C(N)=O)c2)cc1
InChIInChI=1S/C15H15ClN2O4S/c1-2-22-11-4-6-12(7-5-11)23(20,21)18-10-3-8-14(16)13(9-10)15(17)19/h3-9,18H,2H2,1H3,(H2,17,19)
InChIKeyWYUKEYQXTXRCSM-UHFFFAOYSA-N
XLogP2.64
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.82
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-carboxy-4-[(4-ethoxyphenyl)sulfonylamino]phenolate
CID 54710151
2-chloro-N-[(4-ethoxyphenyl)methyl]-5-[(4-methylphenyl)sulfonylamino]benzamide
CID 92671640
2-[4-[(4-ethoxyphenyl)sulfonylamino]phenoxy]acetic acid
CID 1260151
2-chloro-N-[4-[(4-ethoxyphenyl)sulfamoyl]phenyl]-5-nitrobenzamide
CID 17147139
(2-amino-2-oxoethyl) 3,5-bis[(4-ethoxyphenyl)sulfonylamino]benzoate
CID 25046962
ethyl N-[4-[(4-ethoxyphenyl)sulfamoyl]phenyl]carbamate
CID 17147479
5-[(4-bromo-3-methylphenyl)sulfonylamino]-2-chlorobenzamide
CID 35546879
4-ethoxy-N-naphthalen-2-ylbenzenesulfonamide
CID 7938656
3-chloro-N-(4-ethoxyphenyl)-4-fluorobenzenesulfonamide
CID 889995
diethyl 5-[(4-ethoxyphenyl)sulfonylamino]benzene-1,3-dicarboxylate
CID 7938305
4-ethoxy-N-(4-methoxyphenyl)benzenesulfonamide
CID 4202178
4-ethoxy-N-(4-methylphenyl)benzenesulfonamide
CID 925010

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-[(4-ethoxyphenyl)sulfonylamino]benzamide?
The IUPAC name of 2-chloro-5-[(4-ethoxyphenyl)sulfonylamino]benzamide (CID 35546601) is 2-chloro-5-[(4-ethoxyphenyl)sulfonylamino]benzamide.
What is the SMILES notation for 2-chloro-5-[(4-ethoxyphenyl)sulfonylamino]benzamide?
The canonical SMILES for 2-chloro-5-[(4-ethoxyphenyl)sulfonylamino]benzamide is CCOc1ccc(S(=O)(=O)Nc2ccc(Cl)c(C(N)=O)c2)cc1.
What is the InChIKey of 2-chloro-5-[(4-ethoxyphenyl)sulfonylamino]benzamide?
The InChIKey is WYUKEYQXTXRCSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O4S/c1-2-22-11-4-6-12(7-5-11)23(20,21)18-10-3-8-14(16)13(9-10)15(17)19/h3-9,18H,2H2,1H3,(H2,17,19).
What are the key properties of 2-chloro-5-[(4-ethoxyphenyl)sulfonylamino]benzamide?
2-chloro-5-[(4-ethoxyphenyl)sulfonylamino]benzamide has a molecular weight of 354.82 g/mol, XLogP of 2.64, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-[(4-ethoxyphenyl)sulfonylamino]benzamide is sourced from PubChem (CID 35546601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).