异巴兹林C
TL;DR: 异巴兹林C (CAS 133401-03-3) is a chemical compound with molecular formula C11H10ClN3O and molecular weight 235.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
异巴兹林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
| Molecular Formula | C11H10ClN3O |
|---|---|
| Molecular Weight | 235.05 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 60.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 235.05124 |
| Heavy Atoms | 16 |
| Complexity | 429.0 |
Chemical Identifiers
| CAS Number | 133401-03-3 |
|---|---|
| SMILES | CN1C=C2CCN=C3C2=C1C(=O)C(=C3Cl)N |
| InChIKey | QNUUYJZICNRMSA-UHFFFAOYSA-N |
Product Overview
异巴兹林C (CAS 133401-03-3), with molecular formula C11H10ClN3O and molecular weight 235.05 g/mol. IUPAC: 10-amino-9-chloro-2-methyl-2,7-diazatricyclo[6.3.1.04,12]dodeca-1(12),3,7,9-tetraen-11-one.
Chemical Property Profile of 异巴兹林C
Property Insights of 异巴兹林C
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 异巴兹林C. The TPSA of 60.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 异巴兹林C. Following Lipinski's Rule of Five, 异巴兹林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
Frequently Asked Questions
What is the CAS number of 异巴兹林C?
The CAS number of 异巴兹林C is 133401-03-3.
What is the molecular formula of 异巴兹林C?
The molecular formula of 异巴兹林C is C11H10ClN3O.
What is the molecular weight of 异巴兹林C?
The molecular weight of 异巴兹林C is 235.05 g/mol.
Where can I buy 异巴兹林C?
You can request a quote for 异巴兹林C directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 异巴兹林C?
Yes, KEHONG BIO provides custom synthesis services for 异巴兹林C and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.