4-(diethylsulfamoyl)-N-[2-(1,3-thiazol-4-yl)ethyl]benzamide

C16H21N3O3S2 — CID 110284882

IUPAC4-(diethylsulfamoyl)-N-[2-(1,3-thiazol-4-yl)ethyl]benzamide
SMILESCCN(CC)S(=O)(=O)c1ccc(C(=O)NCCc2cscn2)cc1
InChIInChI=1S/C16H21N3O3S2/c1-3-19(4-2)24(21,22)15-7-5-13(6-8-15)16(20)17-10-9-14-11-23-12-18-14/h5-8,11-12H,3-4,9-10H2,1-2H3,(H,17,20)
InChIKeyIRWOUVVXZCRRQE-UHFFFAOYSA-N
MW367.50 g/mol
LogP2.15
Rot. Bonds8

About 4-(diethylsulfamoyl)-N-[2-(1,3-thiazol-4-yl)ethyl]benzamide

4-(diethylsulfamoyl)-N-[2-(1,3-thiazol-4-yl)ethyl]benzamide (PubChem CID 110284882) has the molecular formula C16H21N3O3S2 and a molecular weight of 367.50 g/mol. Its IUPAC name is 4-(diethylsulfamoyl)-N-[2-(1,3-thiazol-4-yl)ethyl]benzamide.

Molecular Properties

Compound Name4-(diethylsulfamoyl)-N-[2-(1,3-thiazol-4-yl)ethyl]benzamide
PubChem CID110284882
Molecular FormulaC16H21N3O3S2
Molecular Weight367.50 g/mol
Exact Mass367.10
IUPAC Name4-(diethylsulfamoyl)-N-[2-(1,3-thiazol-4-yl)ethyl]benzamide
SMILESCCN(CC)S(=O)(=O)c1ccc(C(=O)NCCc2cscn2)cc1
InChIInChI=1S/C16H21N3O3S2/c1-3-19(4-2)24(21,22)15-7-5-13(6-8-15)16(20)17-10-9-14-11-23-12-18-14/h5-8,11-12H,3-4,9-10H2,1-2H3,(H,17,20)
InChIKeyIRWOUVVXZCRRQE-UHFFFAOYSA-N
XLogP2.15
TPSA79.37 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.50
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(diethylsulfamoyl)-N-[2-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]benzamide
CID 110395099
3-methylsulfonyl-N-[2-(1,3-thiazol-4-yl)ethyl]benzamide
CID 110313136
3,4-dichloro-N-[2-(1,3-thiazol-4-yl)ethyl]benzamide
CID 110284874
4-(diethylsulfamoyl)-N-[2-(1,3,5-trimethylpyrazol-4-yl)ethyl]benzamide
CID 86930090
4-(2-hydroxyethylsulfanyl)-N-[2-(1,3-thiazol-4-yl)ethyl]benzamide
CID 77078608
N,N-diethyl-4-[[(4-methylbenzoyl)amino]carbamoyl]benzenesulfonamide
CID 2093173
N-[2-(1H-benzimidazol-2-yl)ethyl]-4-(diethylsulfamoyl)benzamide
CID 21008890
4-(diethylsulfamoyl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]benzamide
CID 47728458
4-amino-3-fluoro-N-[2-(1,3-thiazol-4-yl)ethyl]benzamide
CID 63831827
4-(diethylsulfamoyl)-N-[4-(diethylsulfamoyl)phenyl]benzamide
CID 2081481
N-[2-(cyclohexanecarbonylamino)ethyl]-4-(diethylsulfamoyl)benzamide
CID 55805923
3-(diethylsulfamoyl)-4-methyl-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]benzamide
CID 36695261

Frequently Asked Questions

What is the IUPAC name of 4-(diethylsulfamoyl)-N-[2-(1,3-thiazol-4-yl)ethyl]benzamide?
The IUPAC name of 4-(diethylsulfamoyl)-N-[2-(1,3-thiazol-4-yl)ethyl]benzamide (CID 110284882) is 4-(diethylsulfamoyl)-N-[2-(1,3-thiazol-4-yl)ethyl]benzamide.
What is the SMILES notation for 4-(diethylsulfamoyl)-N-[2-(1,3-thiazol-4-yl)ethyl]benzamide?
The canonical SMILES for 4-(diethylsulfamoyl)-N-[2-(1,3-thiazol-4-yl)ethyl]benzamide is CCN(CC)S(=O)(=O)c1ccc(C(=O)NCCc2cscn2)cc1.
What is the InChIKey of 4-(diethylsulfamoyl)-N-[2-(1,3-thiazol-4-yl)ethyl]benzamide?
The InChIKey is IRWOUVVXZCRRQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O3S2/c1-3-19(4-2)24(21,22)15-7-5-13(6-8-15)16(20)17-10-9-14-11-23-12-18-14/h5-8,11-12H,3-4,9-10H2,1-2H3,(H,17,20).
What are the key properties of 4-(diethylsulfamoyl)-N-[2-(1,3-thiazol-4-yl)ethyl]benzamide?
4-(diethylsulfamoyl)-N-[2-(1,3-thiazol-4-yl)ethyl]benzamide has a molecular weight of 367.50 g/mol, XLogP of 2.15, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(diethylsulfamoyl)-N-[2-(1,3-thiazol-4-yl)ethyl]benzamide is sourced from PubChem (CID 110284882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).