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2H-309S structure
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2H-309S

TL;DR: 2H-309S (CAS 1164104-14-6) is a chemical compound with molecular formula C14H19ClN2O5S2 and molecular weight 394.0424 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

methyl 2-[[2-[(4-chlorophenyl)sulfonylamino]acetyl]amino]-4-methylsulfanylbutanoate

Also Known As: 2H-309S, methyl 2-[(2-{[(4-chlorophenyl)sulfonyl]amino}acetyl)amino]-4-(methylsulfanyl)butanoate, methyl 2-[[2-[(4-chlorophenyl)sulfonylamino]acetyl]amino]-4-methylsulfanylbutanoate, methyl 2-[2-(4-chlorobenzenesulfonamido)acetamido]-4-(methylsulfanyl)butanoate

CAS Number
1164104-14-6
Molecular Formula
C14H19ClN2O5S2
Molecular Weight
394.0424 g/mol
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Technical Specifications

Molecular FormulaC14H19ClN2O5S2
Molecular Weight394.0424 g/mol
XLogP1.8
Topological Polar Surface Area (TPSA)135.0 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors7
Rotatable Bonds10
Exact Mass394.0424 Da
Heavy Atoms24
Complexity516.0
SMILESCOC(=O)C(CCSC)NC(=O)CNS(=O)(=O)C1=CC=C(C=C1)Cl
InChIKeyMKAXKSIQHRBZIE-UHFFFAOYSA-N

Chemical Property Profile of 2H-309S

XLogP
1.8
TPSA (Topological Polar Surface Area)
135.0
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
7
Rotatable Bonds
10
Heavy Atoms
24
Complexity
516.0
Exact Mass
394.0424
Monoisotopic Mass
394.0424
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 2H-309S

The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2H-309S. The TPSA of 135.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2H-309S. Following Lipinski's Rule of Five, 2H-309S has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 2H-309S?

The CAS number of 2H-309S is 1164104-14-6.

What is the molecular formula of 2H-309S?

The molecular formula of 2H-309S is C14H19ClN2O5S2.

What is the molecular weight of 2H-309S?

The molecular weight of 2H-309S is 394.0424 g/mol.

Where can I buy 2H-309S?

You can request a quote for 2H-309S directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2H-309S?

Yes, CoreyChem provides custom synthesis services for 2H-309S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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