1-Propylagroclavine tartrate
TL;DR: 1-Propylagroclavine tartrate (CAS 89930-60-9) is a chemical compound with molecular formula C23H30N2O6 and molecular weight 430.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6aR,10aR)-7,9-dimethyl-4-propyl-6,6a,8,10a-tetrahydroindolo[4,3-fg]quinoline;(2R,3R)-2,3-dihydroxybutanedioic acid
Also Known As: 1-Propylagroclavine tartrate, Indolo[4, ergoline deriv., Indolo(4,3-fg)quinoline, ergoline deriv., 1-Propylagroclavine hydrogen (2R,3R)-tartrate, Indolo(4,3-fg)quinoline, ergoline deriv
| Molecular Formula | C23H30N2O6 |
|---|---|
| Molecular Weight | 430.21 g/mol |
| LogP | 1.83 |
| Topological Polar Surface Area | 123.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 430.2104 |
| Heavy Atoms | 31 |
| Complexity | 563.0 |
Chemical Identifiers
| CAS Number | 89930-60-9 |
|---|---|
| SMILES | CCCN1C=C2C[C@@H]3[C@H](C=C(CN3C)C)C4=C2C1=CC=C4.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O |
| InChIKey | QYFRKSXWBYEURI-XJKHTWGASA-N |
Product Overview
1-Propylagroclavine tartrate (CAS 89930-60-9), with molecular formula C23H30N2O6 and molecular weight 430.21 g/mol. IUPAC: (6aR,10aR)-7,9-dimethyl-4-propyl-6,6a,8,10a-tetrahydroindolo[4,3-fg]quinoline;(2R,3R)-2,3-dihydroxybutanedioic acid.
Chemical Property Profile of 1-Propylagroclavine tartrate
Property Insights of 1-Propylagroclavine tartrate
The XLogP value of 1.83 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Propylagroclavine tartrate. The TPSA of 123.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Propylagroclavine tartrate. Following Lipinski's Rule of Five, 1-Propylagroclavine tartrate has 4 hydrogen bond donor(s) and 7 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 1-Propylagroclavine tartrate?
The CAS number of 1-Propylagroclavine tartrate is 89930-60-9.
What is the molecular formula of 1-Propylagroclavine tartrate?
The molecular formula of 1-Propylagroclavine tartrate is C23H30N2O6.
What is the molecular weight of 1-Propylagroclavine tartrate?
The molecular weight of 1-Propylagroclavine tartrate is 430.21 g/mol.
Where can I buy 1-Propylagroclavine tartrate?
You can request a quote for 1-Propylagroclavine tartrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Propylagroclavine tartrate?
Yes, KEHONG BIO provides custom synthesis services for 1-Propylagroclavine tartrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.