2-Quinolinecarboxylicacid,7-amino-(9CI)
TL;DR: 2-Quinolinecarboxylicacid,7-amino-(9CI) (CAS 4431-79-2) is a chemical compound with molecular formula C10H22ClN2O5PS and molecular weight 348.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[3-(2-chloroethyl)-2-oxo-1,3,2λ5-oxazaphosphinan-2-yl]amino]ethyl propane-1-sulfonate
Also Known As: 2-Quinolinecarboxylicacid,7-amino-(9CI), 2-[[3-(2-chloroethyl)-2-oxo-1,3,2, 1-Propanesulfonicacid,2-((3- ethylester,P-oxide, 1-Propanesulfonic acid, 2-((3-(2-chloroethyl)tetrahydro-2H-1,3,2-oxazaphosphorin-2-yl)amino)ethyl ester, P-oxide, 2-{[3-(2-chloroethyl)-2-oxido-1,3,2-oxazaphosphinan-2-yl]amino}ethyl propane-1-sulfonate
| Molecular Formula | C10H22ClN2O5PS |
|---|---|
| Molecular Weight | 348.07 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 93.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 348.06757 |
| Heavy Atoms | 20 |
| Complexity | 428.0 |
Chemical Identifiers
| CAS Number | 4431-79-2 |
|---|---|
| SMILES | CCCS(=O)(=O)OCCNP1(=O)N(CCCO1)CCCl |
| InChIKey | XNFSEUMNEVOOCN-UHFFFAOYSA-N |
Product Overview
2-Quinolinecarboxylicacid,7-amino-(9CI) (CAS 4431-79-2), with molecular formula C10H22ClN2O5PS and molecular weight 348.07 g/mol. IUPAC: 2-[[3-(2-chloroethyl)-2-oxo-1,3,2λ5-oxazaphosphinan-2-yl]amino]ethyl propane-1-sulfonate.
Chemical Property Profile of 2-Quinolinecarboxylicacid,7-amino-(9CI)
Property Insights of 2-Quinolinecarboxylicacid,7-amino-(9CI)
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Quinolinecarboxylicacid,7-amino-(9CI). The TPSA of 93.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Quinolinecarboxylicacid,7-amino-(9CI). Following Lipinski's Rule of Five, 2-Quinolinecarboxylicacid,7-amino-(9CI) has 1 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 2-Quinolinecarboxylicacid,7-amino-(9CI)?
The CAS number of 2-Quinolinecarboxylicacid,7-amino-(9CI) is 4431-79-2.
What is the molecular formula of 2-Quinolinecarboxylicacid,7-amino-(9CI)?
The molecular formula of 2-Quinolinecarboxylicacid,7-amino-(9CI) is C10H22ClN2O5PS.
What is the molecular weight of 2-Quinolinecarboxylicacid,7-amino-(9CI)?
The molecular weight of 2-Quinolinecarboxylicacid,7-amino-(9CI) is 348.07 g/mol.
Where can I buy 2-Quinolinecarboxylicacid,7-amino-(9CI)?
You can request a quote for 2-Quinolinecarboxylicacid,7-amino-(9CI) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Quinolinecarboxylicacid,7-amino-(9CI)?
Yes, KEHONG BIO provides custom synthesis services for 2-Quinolinecarboxylicacid,7-amino-(9CI) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.