Isobatzelline C
TL;DR: Isobatzelline C (CAS 133401-03-3) is a chemical compound with molecular formula C11H10ClN3O and molecular weight 235.05124 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
Isobatzelline C
10-amino-9-chloro-2-methyl-2,7-diazatricyclo[6.3.1.04,12]dodeca-1(12),3,7,9-tetraen-11-one
Also Known As: Isobatzelline C, amino-chloro-methyl-[?]one, Pyrrolo(4,3,2-de)quinolin-8(1H)-one, 7-amino-6-chloro-3,4-dihydro-1-methyl-, Pyrrolo[4,3,2-de]quinolin-8(1H)-one, 7-amino-6-chloro-3,4-dihydro-1-methyl-, 10-amino-9-chloro-2-methyl-2,7-diazatricyclo[6.3.1.04,12]dodeca-1(12),3,7,9-tetraen-11-one
Technical Specifications
| Molecular Formula | C11H10ClN3O |
| Molecular Weight | 235.05124 g/mol |
| XLogP | 0.8 |
| Topological Polar Surface Area (TPSA) | 60.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 235.05124 Da |
| Heavy Atoms | 16 |
| Complexity | 429.0 |
| SMILES | CN1C=C2CCN=C3C2=C1C(=O)C(=C3Cl)N |
| InChIKey | QNUUYJZICNRMSA-UHFFFAOYSA-N |
Product Description
Applications: Isobatzelline C is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
A fine chemical supplied by CoreyChem, Isobatzelline C (CAS 133401-03-3) has the molecular formula C11H10ClN3O and a molecular weight of 235.05 g/mol. Synonyms include Isobatzelline C and ACMC-20d1u2.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Isobatzelline C
Property Insights of Isobatzelline C
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isobatzelline C. The TPSA of 60.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Isobatzelline C. Following Lipinski's Rule of Five, Isobatzelline C has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Isobatzelline C?
The CAS number of Isobatzelline C is 133401-03-3.
What is the molecular formula of Isobatzelline C?
The molecular formula of Isobatzelline C is C11H10ClN3O.
What is the molecular weight of Isobatzelline C?
The molecular weight of Isobatzelline C is 235.05124 g/mol.
What are the applications of Isobatzelline C?
Isobatzelline C is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Where can I buy Isobatzelline C?
You can request a quote for Isobatzelline C directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Isobatzelline C?
Yes, CoreyChem provides custom synthesis services for Isobatzelline C and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.