KST-1A7837
TL;DR: KST-1A7837 (CAS 722-01-0) is a chemical compound with molecular formula C23H20N2O6 and molecular weight 420.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[[(2S,3S)-3-(benzoyloxycarbamoyl)bicyclo[2.2.1]hept-5-ene-2-carbonyl]amino] benzoate
Also Known As: KST-1A7837, (2s,3s)-n,n'-bis(benzoyloxy)bicyclo[2.2.1]hept-5-ene-2,3-dicarboxamide, [[(2S,3S)-3-(benzoyloxycarbamoyl)bicyclo[2.2.1]hept-5-ene-2-carbonyl]amino] benzoate, N,N-Bis(benzoyloxy)bicyclo[2.2.1]hept-5-ene-2,3-dicarboxamide, (2S,3S)-N~2~,N~3~-Bis(benzoyloxy)bicyclo[2.2.1]hept-5-ene-2,3-dicarboximidic acid
| Molecular Formula | C23H20N2O6 |
|---|---|
| Molecular Weight | 420.13 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 111.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 420.13214 |
| Heavy Atoms | 31 |
| Complexity | 678.0 |
Chemical Identifiers
| CAS Number | 722-01-0 |
|---|---|
| SMILES | C1C2C=CC1[C@@H]([C@H]2C(=O)NOC(=O)C3=CC=CC=C3)C(=O)NOC(=O)C4=CC=CC=C4 |
| InChIKey | GHODQHWTFMVZTK-BTRQGYIVSA-N |
Product Overview
KST-1A7837 (CAS 722-01-0), with molecular formula C23H20N2O6 and molecular weight 420.13 g/mol. IUPAC: [[(2S,3S)-3-(benzoyloxycarbamoyl)bicyclo[2.2.1]hept-5-ene-2-carbonyl]amino] benzoate.
Chemical Property Profile of KST-1A7837
Property Insights of KST-1A7837
The XLogP value of 3.3 indicates that KST-1A7837 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for KST-1A7837. Following Lipinski's Rule of Five, KST-1A7837 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-1A7837?
The CAS number of KST-1A7837 is 722-01-0.
What is the molecular formula of KST-1A7837?
The molecular formula of KST-1A7837 is C23H20N2O6.
What is the molecular weight of KST-1A7837?
The molecular weight of KST-1A7837 is 420.13 g/mol.
Where can I buy KST-1A7837?
You can request a quote for KST-1A7837 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KST-1A7837?
Yes, KEHONG BIO provides custom synthesis services for KST-1A7837 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.