19-Hydroxyvenalstonidine
TL;DR: 19-Hydroxyvenalstonidine (CAS 87387-67-5) is a chemical compound with molecular formula C21H24N2O4 and molecular weight 368.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 20-hydroxy-3-oxa-6,16-diazaheptacyclo[15.2.2.11,6.02,4.09,17.010,15.09,22]docosa-10,12,14-triene-18-carboxylate
Also Known As: 19-Hydroxyvenalstonidine, Methyl 4-hydroxy-6,7-epoxyaspidofractinine-21-carboxylate, Aspidofractinine-3-carboxylic acid, 6,7-epoxy-20-hydroxy-, methyl ester, (2alpha,3beta,5alpha,6alpha,7alpha,20S)-, Aspidofractinine-3-carboxylicacid, 6,7-epoxy-20-hydroxy-, methyl ester, (2a,3b,5a,6a,7a,20S)- (9CI), Aspidofractinine-3-carboxylicacid,6,7-epoxy-20-hydroxy-,methyl ester,(2a,3b,5a,6a,7a,20s)-(9ci)
| Molecular Formula | C21H24N2O4 |
|---|---|
| Molecular Weight | 368.17 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 74.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 368.1736 |
| Heavy Atoms | 27 |
| Complexity | 731.0 |
Chemical Identifiers
| CAS Number | 87387-67-5 |
|---|---|
| SMILES | COC(=O)C1CC23C(CC14C5(C2N(CC5)CC6C3O6)C7=CC=CC=C7N4)O |
| InChIKey | HNUOJNHAJOCKBT-UHFFFAOYSA-N |
Product Overview
19-Hydroxyvenalstonidine (CAS 87387-67-5), with molecular formula C21H24N2O4 and molecular weight 368.17 g/mol. IUPAC: methyl 20-hydroxy-3-oxa-6,16-diazaheptacyclo[15.2.2.11,6.02,4.09,17.010,15.09,22]docosa-10,12,14-triene-18-carboxylate.
Chemical Property Profile of 19-Hydroxyvenalstonidine
Property Insights of 19-Hydroxyvenalstonidine
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 19-Hydroxyvenalstonidine. The TPSA of 74.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 19-Hydroxyvenalstonidine. Following Lipinski's Rule of Five, 19-Hydroxyvenalstonidine has 2 hydrogen bond donor(s) and 6 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 19-Hydroxyvenalstonidine?
The CAS number of 19-Hydroxyvenalstonidine is 87387-67-5.
What is the molecular formula of 19-Hydroxyvenalstonidine?
The molecular formula of 19-Hydroxyvenalstonidine is C21H24N2O4.
What is the molecular weight of 19-Hydroxyvenalstonidine?
The molecular weight of 19-Hydroxyvenalstonidine is 368.17 g/mol.
Where can I buy 19-Hydroxyvenalstonidine?
You can request a quote for 19-Hydroxyvenalstonidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 19-Hydroxyvenalstonidine?
Yes, KEHONG BIO provides custom synthesis services for 19-Hydroxyvenalstonidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.