A2536/0107881
TL;DR: A2536/0107881 (CAS 347324-18-9) is a chemical compound with molecular formula C23H22N2O7S and molecular weight 470.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-(4-hydroxy-3-methoxy-5-nitrophenyl)-2-methyl-5-oxo-7-thiophen-2-yl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: A2536/0107881, methyl 4-(4-hydroxy-3-methoxy-5-nitrophenyl)-2-methyl-5-oxo-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, methyl 4-(4-hydroxy-3-methoxy-5-nitrophenyl)-2-methyl-5-oxo-7-thiophen-2-yl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate, methyl 4-(4-hydroxy-5-methoxy-3-nitrophenyl)-2-methyl-5-oxo-7-(2-thienyl)-1,4, 6,7,8-pentahydroquinoline-3-carboxylate, methyl 4-{4-hydroxy-3-nitro-5-methoxyphenyl}-2-methyl-5-oxo-7-(2-thienyl)-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
| Molecular Formula | C23H22N2O7S |
|---|---|
| Molecular Weight | 470.11 g/mol |
| LogP | 3.9051 |
| Topological Polar Surface Area | 128.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 470.11478 |
| Heavy Atoms | 33 |
| Complexity | 1213.6482 |
Chemical Identifiers
| CAS Number | 347324-18-9 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CS3)C4=CC(=C(C(=C4)OC)O)[N+](=O)[O-])C(=O)OC |
Product Overview
A2536/0107881 (CAS 347324-18-9), with molecular formula C23H22N2O7S and molecular weight 470.11 g/mol. IUPAC: methyl 4-(4-hydroxy-3-methoxy-5-nitrophenyl)-2-methyl-5-oxo-7-thiophen-2-yl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of A2536/0107881
Property Insights of A2536/0107881
The XLogP value of 3.9051 indicates that A2536/0107881 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 128.0 Ų falls within the moderate polarity range, balancing permeability and solubility for A2536/0107881. Following Lipinski's Rule of Five, A2536/0107881 has 2 hydrogen bond donor(s) and 9 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 A2536/0107881?
The CAS number of A2536/0107881 is 347324-18-9.
What is the molecular formula of A2536/0107881?
The molecular formula of A2536/0107881 is C23H22N2O7S.
What is the molecular weight of A2536/0107881?
The molecular weight of A2536/0107881 is 470.11 g/mol.
Where can I buy A2536/0107881?
You can request a quote for A2536/0107881 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2536/0107881?
Yes, KEHONG BIO provides custom synthesis services for A2536/0107881 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.