A2047/0086071
TL;DR: A2047/0086071 (CAS 330551-35-4) is a chemical compound with molecular formula C23H24ClNO6 and molecular weight 445.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
oxolan-2-ylmethyl 4-(6-chloro-1,3-benzodioxol-5-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: A2047/0086071, oxolan-2-ylmethyl 4-(6-chloro-1,3-benzodioxol-5-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate, tetrahydro-2-furanylmethyl 4-(6-chloro-1,3-benzodioxol-5-yl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate, tetrahydrofuran-2-ylmethyl 4-(6-chloro-1,3-benzodioxol-5-yl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, (OXOLAN-2-YL)METHYL 4-(6-CHLORO-2H-1,3-BENZODIOXOL-5-YL)-2-METHYL-5-OXO-1,4,5,6,7,8-HEXAHYDROQUINOLINE-3-CARBOXYLATE
| Molecular Formula | C23H24ClNO6 |
|---|---|
| Molecular Weight | 445.13 g/mol |
| LogP | 3.7588 |
| Topological Polar Surface Area | 83.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 445.1292 |
| Heavy Atoms | 31 |
| Complexity | 1007.5642 |
Chemical Identifiers
| CAS Number | 330551-35-4 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CCCC2=O)C3=CC4=C(C=C3Cl)OCO4)C(=O)OCC5CCCO5 |
Product Overview
A2047/0086071 (CAS 330551-35-4), with molecular formula C23H24ClNO6 and molecular weight 445.13 g/mol. IUPAC: oxolan-2-ylmethyl 4-(6-chloro-1,3-benzodioxol-5-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of A2047/0086071
Property Insights of A2047/0086071
The XLogP value of 3.7588 indicates that A2047/0086071 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.09 Ų falls within the moderate polarity range, balancing permeability and solubility for A2047/0086071. Following Lipinski's Rule of Five, A2047/0086071 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 A2047/0086071?
The CAS number of A2047/0086071 is 330551-35-4.
What is the molecular formula of A2047/0086071?
The molecular formula of A2047/0086071 is C23H24ClNO6.
What is the molecular weight of A2047/0086071?
The molecular weight of A2047/0086071 is 445.13 g/mol.
Where can I buy A2047/0086071?
You can request a quote for A2047/0086071 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2047/0086071?
Yes, KEHONG BIO provides custom synthesis services for A2047/0086071 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.