Pentanoic acid--strychnidin-10-one (1/1)
TL;DR: Pentanoic acid--strychnidin-10-one (1/1) (CAS 6101-07-1) is a chemical compound with molecular formula C26H32N2O4 and molecular weight 436.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4aR,5aS,13aR,15aS,15bR)-4a,5,5a,7,8,13a,15,15a,15b,16-decahydro-2H-4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinolin-14-one;pentanoic acid
Also Known As: Strychnine valerate, Pentanoic acid--strychnidin-10-one (1/1), Pentanoic acid--8alpha-strychnidin-10-one (1/1)
| Molecular Formula | C26H32N2O4 |
|---|---|
| Molecular Weight | 436.24 g/mol |
| LogP | 3.3537 |
| Topological Polar Surface Area | 70.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 436.2362 |
| Heavy Atoms | 32 |
| Complexity | 989.7939 |
Chemical Identifiers
| CAS Number | 6101-07-1 |
|---|---|
| SMILES | CCCCC(=O)O.C1CN2CC3=CCO[C@H]4CC(=O)N5[C@@H]6[C@H]4[C@H]3C[C@H]2C61C7=CC=CC=C75 |
Product Overview
Pentanoic acid--strychnidin-10-one (1/1) (CAS 6101-07-1), with molecular formula C26H32N2O4 and molecular weight 436.24 g/mol. IUPAC: (4aR,5aS,13aR,15aS,15bR)-4a,5,5a,7,8,13a,15,15a,15b,16-decahydro-2H-4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinolin-14-one;pentanoic acid.
Chemical Property Profile of Pentanoic acid--strychnidin-10-one (1/1)
Property Insights of Pentanoic acid--strychnidin-10-one (1/1)
The XLogP value of 3.3537 indicates that Pentanoic acid--strychnidin-10-one (1/1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.08 Ų falls within the moderate polarity range, balancing permeability and solubility for Pentanoic acid--strychnidin-10-one (1/1). Following Lipinski's Rule of Five, Pentanoic acid--strychnidin-10-one (1/1) has 1 hydrogen bond donor(s) and 4 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 Pentanoic acid--strychnidin-10-one (1/1)?
The CAS number of Pentanoic acid--strychnidin-10-one (1/1) is 6101-07-1.
What is the molecular formula of Pentanoic acid--strychnidin-10-one (1/1)?
The molecular formula of Pentanoic acid--strychnidin-10-one (1/1) is C26H32N2O4.
What is the molecular weight of Pentanoic acid--strychnidin-10-one (1/1)?
The molecular weight of Pentanoic acid--strychnidin-10-one (1/1) is 436.24 g/mol.
Where can I buy Pentanoic acid--strychnidin-10-one (1/1)?
You can request a quote for Pentanoic acid--strychnidin-10-one (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pentanoic acid--strychnidin-10-one (1/1)?
Yes, KEHONG BIO provides custom synthesis services for Pentanoic acid--strychnidin-10-one (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.