Dihydrovindoline
TL;DR: Dihydrovindoline (CAS 42881-91-4) is a chemical compound with molecular formula C25H34N2O6 and molecular weight 458.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (9R,10S,11R,12R,19R)-11-acetyloxy-12-ethyl-10-hydroxy-5-methoxy-8-methyl-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2(7),3,5-triene-10-carboxylate
Also Known As: Dihydrovindoline, 14,15-Dihydrovindoline, Vindoline, 6,7-dihydro-, Methyl 4-(acetyloxy)-3-hydroxy-16-methoxy-1-methylaspidospermidine-3-carboxylate, Aspidospermidine-3-carboxylic acid, 4-(acetyloxy)-3-hydroxy-16-methoxy-1-methyl-, methyl ester, (2.beta.,3.beta.,4.beta.,5.alpha.,12.beta.,19.alpha.)-
| Molecular Formula | C25H34N2O6 |
|---|---|
| Molecular Weight | 458.24 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 88.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 458.2417 |
| Heavy Atoms | 33 |
| Complexity | 823.0 |
Chemical Identifiers
| CAS Number | 42881-91-4 |
|---|---|
| SMILES | CC[C@@]12CCCN3[C@@H]1C4(CC3)[C@H]([C@]([C@@H]2OC(=O)C)(C(=O)OC)O)N(C5=C4C=CC(=C5)OC)C |
| InChIKey | ZMQCYQNIMQXFOW-SSBHFPSFSA-N |
Product Overview
Dihydrovindoline (CAS 42881-91-4), with molecular formula C25H34N2O6 and molecular weight 458.24 g/mol. IUPAC: methyl (9R,10S,11R,12R,19R)-11-acetyloxy-12-ethyl-10-hydroxy-5-methoxy-8-methyl-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2(7),3,5-triene-10-carboxylate.
Chemical Property Profile of Dihydrovindoline
Property Insights of Dihydrovindoline
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dihydrovindoline. The TPSA of 88.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Dihydrovindoline. Following Lipinski's Rule of Five, Dihydrovindoline 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 Dihydrovindoline?
The CAS number of Dihydrovindoline is 42881-91-4.
What is the molecular formula of Dihydrovindoline?
The molecular formula of Dihydrovindoline is C25H34N2O6.
What is the molecular weight of Dihydrovindoline?
The molecular weight of Dihydrovindoline is 458.24 g/mol.
Where can I buy Dihydrovindoline?
You can request a quote for Dihydrovindoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dihydrovindoline?
Yes, KEHONG BIO provides custom synthesis services for Dihydrovindoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.