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N-butyl-4-iodobenzenesulfonamide structure
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N-butyl-4-iodobenzenesulfonamide

TL;DR: N-butyl-4-iodobenzenesulfonamide (CAS 1413494-37-7) is a chemical compound with molecular formula C10H14INO2S and molecular weight 338.979 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

N-butyl-4-iodobenzenesulfonamide

Also Known As: N-butyl-4-iodobenzenesulfonamide, butyl[(4-iodophenyl)sulfonyl]amine, AO-548/40950132

CAS Number
1413494-37-7
Molecular Formula
C10H14INO2S
Molecular Weight
338.979 g/mol
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Technical Specifications

Molecular FormulaC10H14INO2S
Molecular Weight338.979 g/mol
XLogP2.8
Topological Polar Surface Area (TPSA)54.6 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors3
Rotatable Bonds5
Exact Mass338.979 Da
Heavy Atoms15
Complexity266.0
SMILESCCCCNS(=O)(=O)C1=CC=C(C=C1)I
InChIKeySIWLSZORFPCKCK-UHFFFAOYSA-N

Chemical Property Profile of N-butyl-4-iodobenzenesulfonamide

XLogP
2.8
TPSA (Topological Polar Surface Area)
54.6
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
3
Rotatable Bonds
5
Heavy Atoms
15
Complexity
266.0
Exact Mass
338.979
Monoisotopic Mass
338.979
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of N-butyl-4-iodobenzenesulfonamide

The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-butyl-4-iodobenzenesulfonamide. With a topological polar surface area (TPSA) of 54.6 Ų, N-butyl-4-iodobenzenesulfonamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-butyl-4-iodobenzenesulfonamide has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of N-butyl-4-iodobenzenesulfonamide?

The CAS number of N-butyl-4-iodobenzenesulfonamide is 1413494-37-7.

What is the molecular formula of N-butyl-4-iodobenzenesulfonamide?

The molecular formula of N-butyl-4-iodobenzenesulfonamide is C10H14INO2S.

What is the molecular weight of N-butyl-4-iodobenzenesulfonamide?

The molecular weight of N-butyl-4-iodobenzenesulfonamide is 338.979 g/mol.

Where can I buy N-butyl-4-iodobenzenesulfonamide?

You can request a quote for N-butyl-4-iodobenzenesulfonamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for N-butyl-4-iodobenzenesulfonamide?

Yes, CoreyChem provides custom synthesis services for N-butyl-4-iodobenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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