A-86929 hydrochloride
TL;DR: A-86929 hydrochloride (CAS 173934-91-3) is a chemical compound with molecular formula C18H22ClNO2S and molecular weight 351.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,10R)-15-propyl-14-thia-11-azatetracyclo[8.7.0.02,7.013,17]heptadeca-2,4,6,13(17),15-pentaene-4,5-diol;hydrochloride
Also Known As: A-86929 hydrochloride, A-86929, 9,10-DIHYDROXY-2-PROPYL-4,5,5A,6,7,11B-HEXAHYDRO-3-THIA-5-AZACYCLOPENT-1-ENA(C)PHENANTHRENE HYDROCHLORIDE, TRANS, L-, (5aR,11bS)-2-Propyl-4,5,5a,6,7,11b-hexahydrobenzo[f]thieno[2,3-c]quinoline-9,10-diol--hydrogen chloride (1/1), Benzo(f)thieno(2,3-c)quinoline-9,10-diol, 4,5,5a,6,7,11b-hexahydro-2-propyl-, hydrochloride, trans
| Molecular Formula | C18H22ClNO2S |
|---|---|
| Molecular Weight | 351.11 g/mol |
| LogP | 4.0835 |
| Topological Polar Surface Area | 52.49 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 351.106 |
| Heavy Atoms | 23 |
| Complexity | 728.05194 |
Chemical Identifiers
| CAS Number | 173934-91-3 |
|---|---|
| SMILES | CCCC1=CC2=C(S1)CN[C@H]3[C@H]2C4=CC(=C(C=C4CC3)O)O.Cl |
Product Overview
A-86929 hydrochloride (CAS 173934-91-3), with molecular formula C18H22ClNO2S and molecular weight 351.11 g/mol. IUPAC: (1S,10R)-15-propyl-14-thia-11-azatetracyclo[8.7.0.02,7.013,17]heptadeca-2,4,6,13(17),15-pentaene-4,5-diol;hydrochloride.
Chemical Property Profile of A-86929 hydrochloride
Property Insights of A-86929 hydrochloride
The XLogP value of 4.0835 indicates that A-86929 hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.49 Ų, A-86929 hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, A-86929 hydrochloride has 3 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 A-86929 hydrochloride?
The CAS number of A-86929 hydrochloride is 173934-91-3.
What is the molecular formula of A-86929 hydrochloride?
The molecular formula of A-86929 hydrochloride is C18H22ClNO2S.
What is the molecular weight of A-86929 hydrochloride?
The molecular weight of A-86929 hydrochloride is 351.11 g/mol.
Where can I buy A-86929 hydrochloride?
You can request a quote for A-86929 hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A-86929 hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for A-86929 hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.