2,4-dichloro-N-(2-methoxy-2-thiophen-3-ylethyl)-5-methylbenzenesulfonamide

C14H15Cl2NO3S2 — CID 90584085

IUPAC2,4-dichloro-N-(2-methoxy-2-thiophen-3-ylethyl)-5-methylbenzenesulfonamide
SMILESCOC(CNS(=O)(=O)c1cc(C)c(Cl)cc1Cl)c1ccsc1
InChIInChI=1S/C14H15Cl2NO3S2/c1-9-5-14(12(16)6-11(9)15)22(18,19)17-7-13(20-2)10-3-4-21-8-10/h3-6,8,13,17H,7H2,1-2H3
InChIKeySUTSWPHBXQUUIV-UHFFFAOYSA-N
MW380.32 g/mol
LogP4.03
Rot. Bonds6

About 2,4-dichloro-N-(2-methoxy-2-thiophen-3-ylethyl)-5-methylbenzenesulfonamide

2,4-dichloro-N-(2-methoxy-2-thiophen-3-ylethyl)-5-methylbenzenesulfonamide (PubChem CID 90584085) has the molecular formula C14H15Cl2NO3S2 and a molecular weight of 380.32 g/mol. Its IUPAC name is 2,4-dichloro-N-(2-methoxy-2-thiophen-3-ylethyl)-5-methylbenzenesulfonamide.

Molecular Properties

Compound Name2,4-dichloro-N-(2-methoxy-2-thiophen-3-ylethyl)-5-methylbenzenesulfonamide
PubChem CID90584085
Molecular FormulaC14H15Cl2NO3S2
Molecular Weight380.32 g/mol
Exact Mass378.99
IUPAC Name2,4-dichloro-N-(2-methoxy-2-thiophen-3-ylethyl)-5-methylbenzenesulfonamide
SMILESCOC(CNS(=O)(=O)c1cc(C)c(Cl)cc1Cl)c1ccsc1
InChIInChI=1S/C14H15Cl2NO3S2/c1-9-5-14(12(16)6-11(9)15)22(18,19)17-7-13(20-2)10-3-4-21-8-10/h3-6,8,13,17H,7H2,1-2H3
InChIKeySUTSWPHBXQUUIV-UHFFFAOYSA-N
XLogP4.03
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.32
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2,4-dichloro-N-(2-methoxy-2-thiophen-3-ylethyl)-5-methylbenzenesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-methoxy-2-thiophen-3-ylethyl)-3,4-dimethylbenzenesulfonamide
CID 90584021
N-(2-methoxy-2-thiophen-3-ylethyl)-2-methyl-5-nitrobenzenesulfonamide
CID 90584070
3-chloro-N-(2-methoxy-2-thiophen-3-ylethyl)benzenesulfonamide
CID 90584031
2-fluoro-N-(2-methoxy-2-thiophen-3-ylethyl)benzenesulfonamide
CID 90584014
2-bromo-N-[(2S)-2-methoxy-2-thiophen-3-ylethyl]benzenesulfonamide
CID 97427133
4-fluoro-N-[(2S)-2-methoxy-2-thiophen-3-ylethyl]-3-methylbenzenesulfonamide
CID 97414472
4-tert-butyl-N-(2-methoxy-2-thiophen-3-ylethyl)benzenesulfonamide
CID 90584060
N-(2-methoxy-2-thiophen-3-ylethyl)thiophene-2-sulfonamide
CID 90584008
2-chloro-N-(2-hydroxy-2-thiophen-3-ylethyl)-5-methylbenzenesulfonamide
CID 75477657
N-(2-methoxy-2-thiophen-3-ylethyl)naphthalene-2-sulfonamide
CID 90584057
2,4-dichloro-N-[2-hydroxy-2-(5-thiophen-3-ylfuran-2-yl)ethyl]-5-methylbenzenesulfonamide
CID 122244261
methyl 4-[(2-methoxy-2-thiophen-3-ylethyl)sulfamoyl]benzoate
CID 71804782

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-N-(2-methoxy-2-thiophen-3-ylethyl)-5-methylbenzenesulfonamide?
The IUPAC name of 2,4-dichloro-N-(2-methoxy-2-thiophen-3-ylethyl)-5-methylbenzenesulfonamide (CID 90584085) is 2,4-dichloro-N-(2-methoxy-2-thiophen-3-ylethyl)-5-methylbenzenesulfonamide.
What is the SMILES notation for 2,4-dichloro-N-(2-methoxy-2-thiophen-3-ylethyl)-5-methylbenzenesulfonamide?
The canonical SMILES for 2,4-dichloro-N-(2-methoxy-2-thiophen-3-ylethyl)-5-methylbenzenesulfonamide is COC(CNS(=O)(=O)c1cc(C)c(Cl)cc1Cl)c1ccsc1.
What is the InChIKey of 2,4-dichloro-N-(2-methoxy-2-thiophen-3-ylethyl)-5-methylbenzenesulfonamide?
The InChIKey is SUTSWPHBXQUUIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15Cl2NO3S2/c1-9-5-14(12(16)6-11(9)15)22(18,19)17-7-13(20-2)10-3-4-21-8-10/h3-6,8,13,17H,7H2,1-2H3.
What are the key properties of 2,4-dichloro-N-(2-methoxy-2-thiophen-3-ylethyl)-5-methylbenzenesulfonamide?
2,4-dichloro-N-(2-methoxy-2-thiophen-3-ylethyl)-5-methylbenzenesulfonamide has a molecular weight of 380.32 g/mol, XLogP of 4.03, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-N-(2-methoxy-2-thiophen-3-ylethyl)-5-methylbenzenesulfonamide is sourced from PubChem (CID 90584085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).