AB00095810-01
TL;DR: AB00095810-01 (CAS 330635-47-7) is a chemical compound with molecular formula C19H14N2O6 and molecular weight 366.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(6,7-dimethoxy-4-oxo-3,1-benzoxazin-2-yl)methyl]isoindole-1,3-dione
Also Known As: AB00095810-01, 2-[(6,7-dimethoxy-4-oxo-4H-3,1-benzoxazin-2-yl)methyl]-1H-isoindole-1,3(2H)-dione, 2-[(6,7-dimethoxy-4-oxo-3,1-benzoxazin-2-yl)methyl]isoindole-1,3-dione
| Molecular Formula | C19H14N2O6 |
|---|---|
| Molecular Weight | 366.09 g/mol |
| LogP | 2.0014 |
| Topological Polar Surface Area | 98.94 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 366.08517 |
| Heavy Atoms | 27 |
| Complexity | 1115.6353 |
Chemical Identifiers
| CAS Number | 330635-47-7 |
|---|---|
| SMILES | COC1=C(C=C2C(=C1)C(=O)OC(=N2)CN3C(=O)C4=CC=CC=C4C3=O)OC |
Product Overview
AB00095810-01 (CAS 330635-47-7), with molecular formula C19H14N2O6 and molecular weight 366.09 g/mol. IUPAC: 2-[(6,7-dimethoxy-4-oxo-3,1-benzoxazin-2-yl)methyl]isoindole-1,3-dione.
Chemical Property Profile of AB00095810-01
Property Insights of AB00095810-01
The XLogP value of 2.0014 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00095810-01. The TPSA of 98.94 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00095810-01. Following Lipinski's Rule of Five, AB00095810-01 has 0 hydrogen bond donor(s) and 7 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 AB00095810-01?
The CAS number of AB00095810-01 is 330635-47-7.
What is the molecular formula of AB00095810-01?
The molecular formula of AB00095810-01 is C19H14N2O6.
What is the molecular weight of AB00095810-01?
The molecular weight of AB00095810-01 is 366.09 g/mol.
Where can I buy AB00095810-01?
You can request a quote for AB00095810-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00095810-01?
Yes, KEHONG BIO provides custom synthesis services for AB00095810-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.