ChemDiv1_009235
TL;DR: ChemDiv1_009235 (CAS 436853-73-5) is a chemical compound with molecular formula C26H26N2O6S and molecular weight 494.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
oxolan-2-ylmethyl 2-methyl-4-(4-nitrophenyl)-5-oxo-7-thiophen-2-yl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: ChemDiv1_009235, AB00122031-01, A2948/0124199, tetrahydrofuran-2-ylmethyl 2-methyl-4-(4-nitrophenyl)-5-oxo-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, (OXOLAN-2-YL)METHYL 2-METHYL-4-(4-NITROPHENYL)-5-OXO-7-(THIOPHEN-2-YL)-1,4,5,6,7,8-HEXAHYDROQUINOLINE-3-CARBOXYLATE
| Molecular Formula | C26H26N2O6S |
|---|---|
| Molecular Weight | 494.15 g/mol |
| LogP | 4.7401 |
| Topological Polar Surface Area | 107.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 494.15115 |
| Heavy Atoms | 35 |
| Complexity | 1208.9766 |
Chemical Identifiers
| CAS Number | 436853-73-5 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CS3)C4=CC=C(C=C4)[N+](=O)[O-])C(=O)OCC5CCCO5 |
Product Overview
ChemDiv1_009235 (CAS 436853-73-5), with molecular formula C26H26N2O6S and molecular weight 494.15 g/mol. IUPAC: oxolan-2-ylmethyl 2-methyl-4-(4-nitrophenyl)-5-oxo-7-thiophen-2-yl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of ChemDiv1_009235
Property Insights of ChemDiv1_009235
The XLogP value of 4.7401 indicates that ChemDiv1_009235 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.77 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_009235. Following Lipinski's Rule of Five, ChemDiv1_009235 has 1 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 ChemDiv1_009235?
The CAS number of ChemDiv1_009235 is 436853-73-5.
What is the molecular formula of ChemDiv1_009235?
The molecular formula of ChemDiv1_009235 is C26H26N2O6S.
What is the molecular weight of ChemDiv1_009235?
The molecular weight of ChemDiv1_009235 is 494.15 g/mol.
Where can I buy ChemDiv1_009235?
You can request a quote for ChemDiv1_009235 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_009235?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_009235 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.