Tai 998
TL;DR: Tai 998 (CAS 66800-35-9) is a chemical compound with molecular formula C18H28ClN and molecular weight 293.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(1R,6R)-6-benzyl-4,4-dimethylcyclohex-2-en-1-yl]-N,N-dimethylmethanamine;hydrochloride
Also Known As: Tai 998, KST-1B7202, N,N-Dimethyl-(6-benzyl-4,4-dimethyl-2-cyclohexenyl)methylamine, 1-[(1r,6r)-6-benzyl-4,4-dimethylcyclohex-2-en-1-yl]-n,n-dimethylmethanamine hydrochloride(1:1), 1-[(1R,6R)-6-benzyl-4,4-dimethylcyclohex-2-en-1-yl]-N,N-dimethylmethanamine;hydrochloride
| Molecular Formula | C18H28ClN |
|---|---|
| Molecular Weight | 293.19 g/mol |
| LogP | 4.431 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 293.19104 |
| Heavy Atoms | 20 |
| Complexity | 297.0 |
Chemical Identifiers
| CAS Number | 66800-35-9 |
|---|---|
| SMILES | CC1(C[C@@H]([C@H](C=C1)CN(C)C)CC2=CC=CC=C2)C.Cl |
| InChIKey | FKLGPFRIJHLUOZ-PPPUBMIESA-N |
Product Overview
Tai 998 (CAS 66800-35-9), with molecular formula C18H28ClN and molecular weight 293.19 g/mol. IUPAC: 1-[(1R,6R)-6-benzyl-4,4-dimethylcyclohex-2-en-1-yl]-N,N-dimethylmethanamine;hydrochloride.
Chemical Property Profile of Tai 998
Property Insights of Tai 998
The XLogP value of 4.431 indicates that Tai 998 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.2 Ų, Tai 998 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tai 998 has 1 hydrogen bond donor(s) and 1 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 Tai 998?
The CAS number of Tai 998 is 66800-35-9.
What is the molecular formula of Tai 998?
The molecular formula of Tai 998 is C18H28ClN.
What is the molecular weight of Tai 998?
The molecular weight of Tai 998 is 293.19 g/mol.
Where can I buy Tai 998?
You can request a quote for Tai 998 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tai 998?
Yes, KEHONG BIO provides custom synthesis services for Tai 998 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.