A1534/0066696
TL;DR: A1534/0066696 (CAS 299451-11-9) is a chemical compound with molecular formula C26H30ClNO5 and molecular weight 471.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyclohexyl 4-(6-chloro-1,3-benzodioxol-5-yl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate
Also Known As: A1534/0066696, cyclohexyl 4-(6-chloro-1,3-benzodioxol-5-yl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate, cyclohexyl 4-(6-chloro-1,3-benzodioxol-5-yl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, cyclohexyl 4-(6-chloro-1,3-benzodioxol-5-yl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate, cyclohexyl 4-(6-chloro(2H-benzo[d]1,3-dioxolen-5-yl))-2,7,7-trimethyl-5-oxo-1, 4,6,7,8-pentahydroquinoline-3-carboxylate
| Molecular Formula | C26H30ClNO5 |
|---|---|
| Molecular Weight | 471.18 g/mol |
| LogP | 5.5486 |
| Topological Polar Surface Area | 73.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 471.18124 |
| Heavy Atoms | 33 |
| Complexity | 1080.3983 |
Chemical Identifiers
| CAS Number | 299451-11-9 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC4=C(C=C3Cl)OCO4)C(=O)OC5CCCCC5 |
Product Overview
A1534/0066696 (CAS 299451-11-9), with molecular formula C26H30ClNO5 and molecular weight 471.18 g/mol. IUPAC: cyclohexyl 4-(6-chloro-1,3-benzodioxol-5-yl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate.
Chemical Property Profile of A1534/0066696
Property Insights of A1534/0066696
The XLogP value of 5.5486 indicates that A1534/0066696 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.86 Ų falls within the moderate polarity range, balancing permeability and solubility for A1534/0066696. Following Lipinski's Rule of Five, A1534/0066696 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A1534/0066696?
The CAS number of A1534/0066696 is 299451-11-9.
What is the molecular formula of A1534/0066696?
The molecular formula of A1534/0066696 is C26H30ClNO5.
What is the molecular weight of A1534/0066696?
The molecular weight of A1534/0066696 is 471.18 g/mol.
Where can I buy A1534/0066696?
You can request a quote for A1534/0066696 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A1534/0066696?
Yes, KEHONG BIO provides custom synthesis services for A1534/0066696 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.