KST-1A2001
TL;DR: KST-1A2001 (CAS 1729-65-3) is a chemical compound with molecular formula C29H51N and molecular weight 413.40 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S,8S,9S,10R,13R,14S,17R)-N,N,10,13-tetramethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-amine
Also Known As: KST-1A2001, (3, A)-n,n-dimethylcholest-5-en-3-amine, (3S,8S,9S,10R,13R,14S,17R)-N,N,10,13-tetramethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-amine
| Molecular Formula | C29H51N |
|---|---|
| Molecular Weight | 413.40 g/mol |
| LogP | 9.3 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 413.40216 |
| Heavy Atoms | 30 |
| Complexity | 632.0 |
Chemical Identifiers
| CAS Number | 1729-65-3 |
|---|---|
| SMILES | C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)N(C)C)C)C |
| InChIKey | WHZUCKVXGABTPN-AXYOXNHISA-N |
Product Overview
KST-1A2001 (CAS 1729-65-3), with molecular formula C29H51N and molecular weight 413.40 g/mol. IUPAC: (3S,8S,9S,10R,13R,14S,17R)-N,N,10,13-tetramethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-amine.
Chemical Property Profile of KST-1A2001
Property Insights of KST-1A2001
The XLogP value of 9.3 indicates that KST-1A2001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.2 Ų, KST-1A2001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, KST-1A2001 has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of KST-1A2001?
The CAS number of KST-1A2001 is 1729-65-3.
What is the molecular formula of KST-1A2001?
The molecular formula of KST-1A2001 is C29H51N.
What is the molecular weight of KST-1A2001?
The molecular weight of KST-1A2001 is 413.40 g/mol.
Where can I buy KST-1A2001?
You can request a quote for KST-1A2001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KST-1A2001?
Yes, KEHONG BIO provides custom synthesis services for KST-1A2001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.