O-Acetylcolchifoline
TL;DR: O-Acetylcolchifoline (CAS 86436-34-2) is a chemical compound with molecular formula C24H27NO8 and molecular weight 457.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-oxo-2-[[(7S)-1,2,3,10-tetramethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]amino]ethyl] acetate
Also Known As: O-Acetylcolchifoline, Acetamide, 2-hydroxy-N-(5,6,7,9-tetrahydro-1,2,3,10-tetramethoxy-9-oxobenzo(a)heptalen-7-yl)-, acetate (ester), (S)-, [2-oxo-2-[[(7S)-1,2,3,10-tetramethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]amino]ethyl] acetate, {[(10S)-3,4,5,14-tetramethoxy-13-oxotricyclo[9.5.0.02,7]hexadeca-1(16),2(7),3,5,11,14-hexaen-10-yl]carbamoyl}methyl acetate, 2-Acetyloxy-N-[ -5,6,7,9-tetrahydro-1,2,3,10-tetramethoxy-9-oxobenzo[a]heptalen-7-yl]acetamide
| Molecular Formula | C24H27NO8 |
|---|---|
| Molecular Weight | 457.17 g/mol |
| LogP | 2.4148 |
| Topological Polar Surface Area | 109.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 457.17368 |
| Heavy Atoms | 33 |
| Complexity | 1128.2155 |
Chemical Identifiers
| CAS Number | 86436-34-2 |
|---|---|
| SMILES | CC(=O)OCC(=O)N[C@H]1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)OC)OC)OC)OC |
Product Overview
O-Acetylcolchifoline (CAS 86436-34-2), with molecular formula C24H27NO8 and molecular weight 457.17 g/mol. IUPAC: [2-oxo-2-[[(7S)-1,2,3,10-tetramethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]amino]ethyl] acetate.
Chemical Property Profile of O-Acetylcolchifoline
Property Insights of O-Acetylcolchifoline
The XLogP value of 2.4148 suggests moderate lipophilicity, balancing water solubility and membrane permeability for O-Acetylcolchifoline. The TPSA of 109.39 Ų falls within the moderate polarity range, balancing permeability and solubility for O-Acetylcolchifoline. Following Lipinski's Rule of Five, O-Acetylcolchifoline 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 O-Acetylcolchifoline?
The CAS number of O-Acetylcolchifoline is 86436-34-2.
What is the molecular formula of O-Acetylcolchifoline?
The molecular formula of O-Acetylcolchifoline is C24H27NO8.
What is the molecular weight of O-Acetylcolchifoline?
The molecular weight of O-Acetylcolchifoline is 457.17 g/mol.
Where can I buy O-Acetylcolchifoline?
You can request a quote for O-Acetylcolchifoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for O-Acetylcolchifoline?
Yes, KEHONG BIO provides custom synthesis services for O-Acetylcolchifoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.