KST-1A0285
TL;DR: KST-1A0285 (CAS 3485-08-3) is a chemical compound with molecular formula C14H21N3O4S and molecular weight 327.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,5R,6R)-6-[(1-aminocyclopentanecarbonyl)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
Also Known As: KST-1A0285, (2s,5r,6r)-6-{[(1-aminocyclopentyl)carbonyl]amino}-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-(((1-Aminocyclopentyl)carbonyl)amino)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 6alpha-[[(1-Aminocyclopentyl)carbonyl]amino]penicillanic acid, (2S,5beta)-6alpha-[[(1-Aminocyclopentyl)carbonyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2beta-carboxylic acid
| Molecular Formula | C14H21N3O4S |
|---|---|
| Molecular Weight | 327.13 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 138.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 327.12527 |
| Heavy Atoms | 22 |
| Complexity | 544.0 |
Chemical Identifiers
| CAS Number | 3485-08-3 |
|---|---|
| SMILES | CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)C3(CCCC3)N)C(=O)O)C |
| InChIKey | JBSBDUODFNGBJT-KHQFGBGNSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
KST-1A0285 (CAS 3485-08-3), with molecular formula C14H21N3O4S and molecular weight 327.13 g/mol. IUPAC: (2S,5R,6R)-6-[(1-aminocyclopentanecarbonyl)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid.
Chemical Property Profile of KST-1A0285
Property Insights of KST-1A0285
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for KST-1A0285. The TPSA of 138.0 Ų falls within the moderate polarity range, balancing permeability and solubility for KST-1A0285. Following Lipinski's Rule of Five, KST-1A0285 has 3 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-1A0285?
The CAS number of KST-1A0285 is 3485-08-3.
What is the molecular formula of KST-1A0285?
The molecular formula of KST-1A0285 is C14H21N3O4S.
What is the molecular weight of KST-1A0285?
The molecular weight of KST-1A0285 is 327.13 g/mol.
Where can I buy KST-1A0285?
You can request a quote for KST-1A0285 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KST-1A0285?
Yes, KEHONG BIO provides custom synthesis services for KST-1A0285 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.