S 14001
TL;DR: S 14001 (CAS 136071-58-4) is a chemical compound with molecular formula C15H23FN2O5S and molecular weight 362.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[(6-fluoro-1,2,3,4-tetrahydroquinolin-8-yl)oxymethyl]morpholine;methanesulfonic acid
Also Known As: S 14001, s14-001, S-14001, (S)Fluoro-6(morpholinyl-2-methoxy)-8-tetrahydro-1,2,3,4-quinoline, (2S)-2-[(6-Fluoro-1,2,3,4-tetrahydroquinolin-8-yl)oxymethyl]morpholine;methanesulfonic acid
| Molecular Formula | C15H23FN2O5S |
|---|---|
| Molecular Weight | 362.13 g/mol |
| LogP | 1.055 |
| Topological Polar Surface Area | 105.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 362.13116 |
| Heavy Atoms | 24 |
| Complexity | 385.0 |
Chemical Identifiers
| CAS Number | 136071-58-4 |
|---|---|
| SMILES | CS(=O)(=O)O.C1CC2=C(C(=CC(=C2)F)OC[C@@H]3CNCCO3)NC1 |
| InChIKey | QDKDQSVUUBXMKG-YDALLXLXSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
S 14001 (CAS 136071-58-4), with molecular formula C15H23FN2O5S and molecular weight 362.13 g/mol. IUPAC: (2S)-2-[(6-fluoro-1,2,3,4-tetrahydroquinolin-8-yl)oxymethyl]morpholine;methanesulfonic acid.
Chemical Property Profile of S 14001
Property Insights of S 14001
The XLogP value of 1.055 suggests moderate lipophilicity, balancing water solubility and membrane permeability for S 14001. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for S 14001. Following Lipinski's Rule of Five, S 14001 has 3 hydrogen bond donor(s) and 8 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 S 14001?
The CAS number of S 14001 is 136071-58-4.
What is the molecular formula of S 14001?
The molecular formula of S 14001 is C15H23FN2O5S.
What is the molecular weight of S 14001?
The molecular weight of S 14001 is 362.13 g/mol.
Where can I buy S 14001?
You can request a quote for S 14001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S 14001?
Yes, KEHONG BIO provides custom synthesis services for S 14001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.