RefChem:146244
TL;DR: RefChem:146244 (CAS 75113-50-7) is a chemical compound with molecular formula C18H33N3O4S and molecular weight 387.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[benzenesulfonyl(methyl)amino]hexanoic acid;N',N'-dimethylpropane-1,3-diamine
Also Known As: Hexanoic acid, 6-(methyl(phenylsulfonyl)amino)-, compd. with N,N-dimethyl-1,3-propanediamine (1:1), Hexanoic acid, 6-[methyl(phenylsulfonyl)amino]-, compd. with N,N-dimethyl-1,3-propanediamine (1:1), Hexanoic acid, 6-(methyl(phenylsulfonyl)amino)-, compd. with N1,N1-dimethyl-1,3-propanediamine (1:1), 6-(N-Methylbenzenesulfonamido)hexanoic acid--N~1~,N~1~-dimethylpropane-1,3-diamine (1/1), 6-[benzenesulfonyl(methyl)amino]hexanoic acid,N',N'-dimethylpropane-1,3-diamine
| Molecular Formula | C18H33N3O4S |
|---|---|
| Molecular Weight | 387.22 g/mol |
| LogP | 1.8489 |
| Topological Polar Surface Area | 112.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 387.21918 |
| Heavy Atoms | 26 |
| Complexity | 404.0 |
Chemical Identifiers
| CAS Number | 75113-50-7 |
|---|---|
| SMILES | CN(C)CCCN.CN(CCCCCC(=O)O)S(=O)(=O)C1=CC=CC=C1 |
| InChIKey | XFNAVQSFEFFGOW-UHFFFAOYSA-N |
Product Overview
RefChem:146244 (CAS 75113-50-7), with molecular formula C18H33N3O4S and molecular weight 387.22 g/mol. IUPAC: 6-[benzenesulfonyl(methyl)amino]hexanoic acid;N',N'-dimethylpropane-1,3-diamine.
Chemical Property Profile of RefChem:146244
Property Insights of RefChem:146244
The XLogP value of 1.8489 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:146244. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:146244. Following Lipinski's Rule of Five, RefChem:146244 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
Frequently Asked Questions
What is the CAS number of RefChem:146244?
The CAS number of RefChem:146244 is 75113-50-7.
What is the molecular formula of RefChem:146244?
The molecular formula of RefChem:146244 is C18H33N3O4S.
What is the molecular weight of RefChem:146244?
The molecular weight of RefChem:146244 is 387.22 g/mol.
Where can I buy RefChem:146244?
You can request a quote for RefChem:146244 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:146244?
Yes, KEHONG BIO provides custom synthesis services for RefChem:146244 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.