KST-1A2161
TL;DR: KST-1A2161 (CAS 181038-30-2) is a chemical compound with molecular formula C29H48N2 and molecular weight 424.38 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,2S,5R,6R,9S,10S)-1,5-dimethyl-6-[(2R)-6-methylheptan-2-yl]-14,18-diazapentacyclo[11.8.0.02,10.05,9.014,19]henicosa-12,18-diene
Also Known As: KST-1A2161, (6ar,6bs,8ar,9r,11as,11bs)-6a,8a-dimethyl-9-[(2r)-6-methylheptan-2-yl]-1,2,3,5,6,6a,6b,7,8,8a,9,10,11,11a,11b,12-hexadecahydroindeno[5,4-f]pyrimido[1,2-a]quinoline, (6ar,6bs,8ar,9r,11as,11bs)-6a,8a-dimethyl-9-[(2r)-6-methylhe, 1',4',5',6'-Tetrahydro-pyrimidino<4,3-b>-4-aza-cholest-5-en
| Molecular Formula | C29H48N2 |
|---|---|
| Molecular Weight | 424.38 g/mol |
| LogP | 8.0 |
| Topological Polar Surface Area | 15.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 424.38174 |
| Heavy Atoms | 31 |
| Complexity | 735.0 |
Chemical Identifiers
| CAS Number | 181038-30-2 |
|---|---|
| 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(CCC5=NCCCN54)C)C |
| InChIKey | GADHUERTDPPUEB-CMKWDTBOSA-N |
Product Overview
KST-1A2161 (CAS 181038-30-2), with molecular formula C29H48N2 and molecular weight 424.38 g/mol. IUPAC: (1R,2S,5R,6R,9S,10S)-1,5-dimethyl-6-[(2R)-6-methylheptan-2-yl]-14,18-diazapentacyclo[11.8.0.02,10.05,9.014,19]henicosa-12,18-diene.
Chemical Property Profile of KST-1A2161
Property Insights of KST-1A2161
The XLogP value of 8.0 indicates that KST-1A2161 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 15.6 Ų, KST-1A2161 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, KST-1A2161 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-1A2161?
The CAS number of KST-1A2161 is 181038-30-2.
What is the molecular formula of KST-1A2161?
The molecular formula of KST-1A2161 is C29H48N2.
What is the molecular weight of KST-1A2161?
The molecular weight of KST-1A2161 is 424.38 g/mol.
Where can I buy KST-1A2161?
You can request a quote for KST-1A2161 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KST-1A2161?
Yes, KEHONG BIO provides custom synthesis services for KST-1A2161 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.