Methyl 18-[(3-aminobenzoyl)oxy]-11,17-dimethoxyyohimban-16-carboxylate
TL;DR: Methyl 18-[(3-aminobenzoyl)oxy]-11,17-dimethoxyyohimban-16-carboxylate (CAS 6325-07-1) is a chemical compound with molecular formula C30H35N3O6 and molecular weight 533.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 17-(3-aminobenzoyl)oxy-6,18-dimethoxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate
Also Known As: methyl (3-aminobenzoyl)oxy-dimethoxy-[?]carboxylate, Methyl 18-[(3-aminobenzoyl)oxy]-11,17-dimethoxyyohimban-16-carboxylate
| Molecular Formula | C30H35N3O6 |
|---|---|
| Molecular Weight | 533.25 g/mol |
| LogP | 3.7275 |
| Topological Polar Surface Area | 116.11 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 533.25256 |
| Heavy Atoms | 39 |
| Complexity | 1402.5955 |
Chemical Identifiers
| CAS Number | 6325-07-1 |
|---|---|
| SMILES | COC1C(CC2CN3CCC4=C(C3CC2C1C(=O)OC)NC5=C4C=CC(=C5)OC)OC(=O)C6=CC(=CC=C6)N |
Product Overview
Methyl 18-[(3-aminobenzoyl)oxy]-11,17-dimethoxyyohimban-16-carboxylate (CAS 6325-07-1), with molecular formula C30H35N3O6 and molecular weight 533.25 g/mol. IUPAC: methyl 17-(3-aminobenzoyl)oxy-6,18-dimethoxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate.
Chemical Property Profile of Methyl 18-[(3-aminobenzoyl)oxy]-11,17-dimethoxyyohimban-16-carboxylate
Property Insights of Methyl 18-[(3-aminobenzoyl)oxy]-11,17-dimethoxyyohimban-16-carboxylate
The XLogP value of 3.7275 indicates that Methyl 18-[(3-aminobenzoyl)oxy]-11,17-dimethoxyyohimban-16-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.11 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 18-[(3-aminobenzoyl)oxy]-11,17-dimethoxyyohimban-16-carboxylate. Following Lipinski's Rule of Five, Methyl 18-[(3-aminobenzoyl)oxy]-11,17-dimethoxyyohimban-16-carboxylate has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methyl 18-[(3-aminobenzoyl)oxy]-11,17-dimethoxyyohimban-16-carboxylate?
The CAS number of Methyl 18-[(3-aminobenzoyl)oxy]-11,17-dimethoxyyohimban-16-carboxylate is 6325-07-1.
What is the molecular formula of Methyl 18-[(3-aminobenzoyl)oxy]-11,17-dimethoxyyohimban-16-carboxylate?
The molecular formula of Methyl 18-[(3-aminobenzoyl)oxy]-11,17-dimethoxyyohimban-16-carboxylate is C30H35N3O6.
What is the molecular weight of Methyl 18-[(3-aminobenzoyl)oxy]-11,17-dimethoxyyohimban-16-carboxylate?
The molecular weight of Methyl 18-[(3-aminobenzoyl)oxy]-11,17-dimethoxyyohimban-16-carboxylate is 533.25 g/mol.
Where can I buy Methyl 18-[(3-aminobenzoyl)oxy]-11,17-dimethoxyyohimban-16-carboxylate?
You can request a quote for Methyl 18-[(3-aminobenzoyl)oxy]-11,17-dimethoxyyohimban-16-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 18-[(3-aminobenzoyl)oxy]-11,17-dimethoxyyohimban-16-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 18-[(3-aminobenzoyl)oxy]-11,17-dimethoxyyohimban-16-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.