KST-1B7942
TL;DR: KST-1B7942 (CAS 7143-17-1) is a chemical compound with molecular formula C25H27N3O5 and molecular weight 449.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[7-[(2S)-2-hydroxy-1-oxo-1-(propan-2-ylamino)butan-2-yl]-9-oxo-11H-indolizino[1,2-b]quinolin-8-yl]methyl acetate
Also Known As: KST-1B7942, {7-[(2s)-2-hydroxy-1-oxo-1-(propan-2-ylamino)butan-2-yl]-9-oxo-9,11-dihydroindolizino[1,2-b]quinolin-8-yl}methyl acetate, Indolizino(1,2-b)quinoline-7-acetamide, 8-((acetyloxy)methyl)-alpha-ethyl-9,11-dihydro-alpha-hydroxy-N-(1-methylethyl)-9-oxo-, (S)-, (2S)-2-{8-[(Acetyloxy)methyl]-9-oxo-9,11-dihydroindolizino[1,2-b]quinolin-7-yl}-2-hydroxy-N-(propan-2-yl)butanimidic acid, [7-[(2S)-2-hydroxy-1-oxo-1-(propan-2-ylamino)butan-2-yl]-9-oxo-11H-indolizino[1,2-b]quinolin-8-yl]methyl acetate
| Molecular Formula | C25H27N3O5 |
|---|---|
| Molecular Weight | 449.20 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 109.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 449.19507 |
| Heavy Atoms | 33 |
| Complexity | 894.0 |
Chemical Identifiers
| CAS Number | 7143-17-1 |
|---|---|
| SMILES | CC[C@](C1=C(C(=O)N2CC3=CC4=CC=CC=C4N=C3C2=C1)COC(=O)C)(C(=O)NC(C)C)O |
| InChIKey | CRUCPCCNRBFPJH-VWLOTQADSA-N |
Product Overview
KST-1B7942 (CAS 7143-17-1), with molecular formula C25H27N3O5 and molecular weight 449.20 g/mol. IUPAC: [7-[(2S)-2-hydroxy-1-oxo-1-(propan-2-ylamino)butan-2-yl]-9-oxo-11H-indolizino[1,2-b]quinolin-8-yl]methyl acetate.
Chemical Property Profile of KST-1B7942
Property Insights of KST-1B7942
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for KST-1B7942. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for KST-1B7942. Following Lipinski's Rule of Five, KST-1B7942 has 2 hydrogen bond donor(s) and 6 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 KST-1B7942?
The CAS number of KST-1B7942 is 7143-17-1.
What is the molecular formula of KST-1B7942?
The molecular formula of KST-1B7942 is C25H27N3O5.
What is the molecular weight of KST-1B7942?
The molecular weight of KST-1B7942 is 449.20 g/mol.
Where can I buy KST-1B7942?
You can request a quote for KST-1B7942 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KST-1B7942?
Yes, KEHONG BIO provides custom synthesis services for KST-1B7942 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.