Heptanoic acid, 7-benzenesulfonylamino
TL;DR: Heptanoic acid, 7-benzenesulfonylamino (CAS 123469-53-4) is a chemical compound with molecular formula C13H19NO4S and molecular weight 285.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(benzenesulfonamido)heptanoic acid
Also Known As: 7-[(phenylsulfonyl)amino]heptanoic acid, 7-benzenesulfonamidoheptanoic acid, 7-(benzenesulfonamido)heptanoic acid, 7-(Phenylsulfonamido)heptanoic acid, 7-Benzenesulfonylamino-heptanoic acid
| Molecular Formula | C13H19NO4S |
|---|---|
| Molecular Weight | 285.10 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 83.47 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 285.1035 |
| Heavy Atoms | 19 |
| Complexity | 484.6245 |
Chemical Identifiers
| CAS Number | 123469-53-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)S(=O)(=O)NCCCCCCC(=O)O |
Product Overview
Heptanoic acid, 7-benzenesulfonylamino (CAS 123469-53-4), with molecular formula C13H19NO4S and molecular weight 285.10 g/mol. IUPAC: 7-(benzenesulfonamido)heptanoic acid.
Chemical Property Profile of Heptanoic acid, 7-benzenesulfonylamino
Property Insights of Heptanoic acid, 7-benzenesulfonylamino
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Heptanoic acid, 7-benzenesulfonylamino. The TPSA of 83.47 Ų falls within the moderate polarity range, balancing permeability and solubility for Heptanoic acid, 7-benzenesulfonylamino. Following Lipinski's Rule of Five, Heptanoic acid, 7-benzenesulfonylamino has 2 hydrogen bond donor(s) and 3 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 Heptanoic acid, 7-benzenesulfonylamino?
The CAS number of Heptanoic acid, 7-benzenesulfonylamino is 123469-53-4.
What is the molecular formula of Heptanoic acid, 7-benzenesulfonylamino?
The molecular formula of Heptanoic acid, 7-benzenesulfonylamino is C13H19NO4S.
What is the molecular weight of Heptanoic acid, 7-benzenesulfonylamino?
The molecular weight of Heptanoic acid, 7-benzenesulfonylamino is 285.10 g/mol.
Where can I buy Heptanoic acid, 7-benzenesulfonylamino?
You can request a quote for Heptanoic acid, 7-benzenesulfonylamino directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Heptanoic acid, 7-benzenesulfonylamino?
Yes, KEHONG BIO provides custom synthesis services for Heptanoic acid, 7-benzenesulfonylamino and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.