Compd.
TL;DR: Compd. (CAS 75113-57-4) is a chemical compound with molecular formula C15H26N2O5S and molecular weight 346.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Compd.
2-aminoethanol;6-[benzenesulfonyl(methyl)amino]hexanoic acid
Also Known As: Compd., Hexanoic acid, 6-(methyl(phenylsulfonyl)amino)-, compd. with 2-aminoethanol (1:1), Hexanoic acid, 6-[methyl(phenylsulfonyl)amino]-, compd. with 2-aminoethanol (1:1), 6-(Methyl(phenylsulphonyl)amino)hexanoic acid, compound with 2-aminoethanol (1:1), 2-aminoethanol,6-[benzenesulfonyl(methyl)amino]hexanoic acid
| Molecular Formula | C15H26N2O5S |
|---|---|
| Molecular Weight | 346.16 g/mol |
| LogP | 0.8895 |
| Topological Polar Surface Area | 129.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 346.15625 |
| Heavy Atoms | 23 |
| Complexity | 379.0 |
Chemical Identifiers
| CAS Number | 75113-57-4 |
|---|---|
| SMILES | CN(CCCCCC(=O)O)S(=O)(=O)C1=CC=CC=C1.C(CO)N |
| InChIKey | DUFAUUOAXDKLGV-UHFFFAOYSA-N |
Product Overview
Compd. (CAS 75113-57-4), with molecular formula C15H26N2O5S and molecular weight 346.16 g/mol. IUPAC: 2-aminoethanol;6-[benzenesulfonyl(methyl)amino]hexanoic acid.
Chemical Property Profile of Compd.
Property Insights of Compd.
The XLogP value of 0.8895 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Compd.. The TPSA of 129.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Compd.. Following Lipinski's Rule of Five, Compd. has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Compd.?
The CAS number of Compd. is 75113-57-4.
What is the molecular formula of Compd.?
The molecular formula of Compd. is C15H26N2O5S.
What is the molecular weight of Compd.?
The molecular weight of Compd. is 346.16 g/mol.
Where can I buy Compd.?
You can request a quote for Compd. directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Compd.?
Yes, KEHONG BIO provides custom synthesis services for Compd. and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.