考布他酮E
TL;DR: 考布他酮E (CAS 662167-19-3) is a chemical compound with molecular formula C10H9N3O and molecular weight 187.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
考布他酮E
5-amino-7-methyliminoisoquinolin-8-one
Also Known As: Caulibugulone E, UPCMLD00WCaulibugE, 5-amino-7-methyliminoisoquinolin-8-one, 5-imino-7-(methylamino)isoquinolin-8(5H)-one, J2.007.140K
| Molecular Formula | C10H9N3O |
|---|---|
| Molecular Weight | 187.07 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 68.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 187.07455 |
| Heavy Atoms | 14 |
| Complexity | 319.0 |
Chemical Identifiers
| CAS Number | 662167-19-3 |
|---|---|
| SMILES | CN=C1C=C(C2=C(C1=O)C=NC=C2)N |
| InChIKey | DWAVIPRVWSUPLT-UHFFFAOYSA-N |
Product Overview
考布他酮E (CAS 662167-19-3), with molecular formula C10H9N3O and molecular weight 187.07 g/mol. IUPAC: 5-amino-7-methyliminoisoquinolin-8-one.
Chemical Property Profile of 考布他酮E
Property Insights of 考布他酮E
The XLogP value of -0.4 indicates that 考布他酮E is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 68.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 考布他酮E. Following Lipinski's Rule of Five, 考布他酮E has 1 hydrogen bond donor(s) and 4 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 考布他酮E?
The CAS number of 考布他酮E is 662167-19-3.
What is the molecular formula of 考布他酮E?
The molecular formula of 考布他酮E is C10H9N3O.
What is the molecular weight of 考布他酮E?
The molecular weight of 考布他酮E is 187.07 g/mol.
Where can I buy 考布他酮E?
You can request a quote for 考布他酮E directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 考布他酮E?
Yes, KEHONG BIO provides custom synthesis services for 考布他酮E and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.