2,3-dichloro-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]benzamide

C19H22Cl2N2O3S — CID 112765419

IUPAC2,3-dichloro-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]benzamide
SMILESCCN(CC)S(=O)(=O)c1ccc(C(C)NC(=O)c2cccc(Cl)c2Cl)cc1
InChIInChI=1S/C19H22Cl2N2O3S/c1-4-23(5-2)27(25,26)15-11-9-14(10-12-15)13(3)22-19(24)16-7-6-8-17(20)18(16)21/h6-13H,4-5H2,1-3H3,(H,22,24)
InChIKeyAMSHQZDVPAPXNV-UHFFFAOYSA-N
MW429.37 g/mol
LogP4.51
Rot. Bonds7

About 2,3-dichloro-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]benzamide

2,3-dichloro-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]benzamide (PubChem CID 112765419) has the molecular formula C19H22Cl2N2O3S and a molecular weight of 429.37 g/mol. Its IUPAC name is 2,3-dichloro-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]benzamide.

Molecular Properties

Compound Name2,3-dichloro-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]benzamide
PubChem CID112765419
Molecular FormulaC19H22Cl2N2O3S
Molecular Weight429.37 g/mol
Exact Mass428.07
IUPAC Name2,3-dichloro-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]benzamide
SMILESCCN(CC)S(=O)(=O)c1ccc(C(C)NC(=O)c2cccc(Cl)c2Cl)cc1
InChIInChI=1S/C19H22Cl2N2O3S/c1-4-23(5-2)27(25,26)15-11-9-14(10-12-15)13(3)22-19(24)16-7-6-8-17(20)18(16)21/h6-13H,4-5H2,1-3H3,(H,22,24)
InChIKeyAMSHQZDVPAPXNV-UHFFFAOYSA-N
XLogP4.51
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500429.37
LogP ≤ 54.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,3-dichloro-N-[1-[4-(dimethylsulfamoyl)phenyl]ethyl]benzamide
CID 55894518
N-[(1S)-1-[4-(diethylsulfamoyl)phenyl]ethyl]-2-(trifluoromethyl)benzamide
CID 32752664
1-[1-(2-chlorophenyl)ethyl]-3-[1-[4-(diethylsulfamoyl)phenyl]ethyl]urea
CID 55473706
N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]-2,6-difluorobenzamide
CID 51151532
N-[1-(4-chlorophenyl)ethyl]-2-[(4-chlorophenyl)sulfonyl-ethylamino]acetamide
CID 43872409
N-[(1R)-1-(4-chlorophenyl)ethyl]-2-[(4-chlorophenyl)sulfonyl-ethylamino]acetamide
CID 28547139
3-(2-chloro-6-fluorophenyl)-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]-5-methyl-1,2-oxazole-4-carboxamide
CID 112765432
N-[(1R)-1-[4-(diethylsulfamoyl)phenyl]ethyl]-5-methylthiophene-2-carboxamide
CID 31526246
N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]-4-iodobenzamide
CID 55339070
5-chloro-N-[(1R)-1-[4-(diethylsulfamoyl)phenyl]ethyl]-2,3-dihydro-1,4-benzodioxine-7-carboxamide
CID 39758913
2,3-dichloro-N-[(1R)-1-[4-(trifluoromethyl)phenyl]ethyl]benzamide
CID 37354874
(2R)-2-amino-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]propanamide
CID 119269826

Frequently Asked Questions

What is the IUPAC name of 2,3-dichloro-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]benzamide?
The IUPAC name of 2,3-dichloro-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]benzamide (CID 112765419) is 2,3-dichloro-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]benzamide.
What is the SMILES notation for 2,3-dichloro-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]benzamide?
The canonical SMILES for 2,3-dichloro-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]benzamide is CCN(CC)S(=O)(=O)c1ccc(C(C)NC(=O)c2cccc(Cl)c2Cl)cc1.
What is the InChIKey of 2,3-dichloro-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]benzamide?
The InChIKey is AMSHQZDVPAPXNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22Cl2N2O3S/c1-4-23(5-2)27(25,26)15-11-9-14(10-12-15)13(3)22-19(24)16-7-6-8-17(20)18(16)21/h6-13H,4-5H2,1-3H3,(H,22,24).
What are the key properties of 2,3-dichloro-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]benzamide?
2,3-dichloro-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]benzamide has a molecular weight of 429.37 g/mol, XLogP of 4.51, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dichloro-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]benzamide is sourced from PubChem (CID 112765419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).