Linotroban
TL;DR: Linotroban (CAS 120824-08-0) is a chemical compound with molecular formula C14H15NO5S2 and molecular weight 341.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[5-[2-(benzenesulfonamido)ethyl]thiophen-2-yl]oxyacetic acid
Also Known As: Linotroban, linotrobanum, Linotroban [INN], Withagulatin A, 2-[5-[2-(benzenesulfonamido)ethyl]thiophen-2-yl]oxyacetic acid
| Molecular Formula | C14H15NO5S2 |
|---|---|
| Molecular Weight | 341.04 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 129.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 341.03915 |
| Heavy Atoms | 22 |
| Complexity | 456.0 |
Chemical Identifiers
| CAS Number | 120824-08-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)S(=O)(=O)NCCC2=CC=C(S2)OCC(=O)O |
| InChIKey | ISSKMEQROMFEHL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Linotroban (CAS 120824-08-0), with molecular formula C14H15NO5S2 and molecular weight 341.04 g/mol. IUPAC: 2-[5-[2-(benzenesulfonamido)ethyl]thiophen-2-yl]oxyacetic acid.
Chemical Property Profile of Linotroban
Property Insights of Linotroban
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Linotroban. The TPSA of 129.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Linotroban. Following Lipinski's Rule of Five, Linotroban 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 Linotroban?
The CAS number of Linotroban is 120824-08-0.
What is the molecular formula of Linotroban?
The molecular formula of Linotroban is C14H15NO5S2.
What is the molecular weight of Linotroban?
The molecular weight of Linotroban is 341.04 g/mol.
Where can I buy Linotroban?
You can request a quote for Linotroban directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Linotroban?
Yes, KEHONG BIO provides custom synthesis services for Linotroban and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.