AB00411520-02
TL;DR: AB00411520-02 (CAS 851977-72-5) is a chemical compound with molecular formula C21H17N3O6S and molecular weight 439.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-(furan-2-carbonylamino)-3-(4-methoxyphenyl)-4-oxothieno[3,4-d]pyridazine-1-carboxylate
Also Known As: AB00411520-02, F0641-0758, ethyl 5-(furan-2-carbonylamino)-3-(4-methoxyphenyl)-4-oxothieno[3,4-d]pyridazine-1-carboxylate, ethyl 5-(2-furoylamino)-3-(4-methoxyphenyl)-4-oxo-3,4-dihydrothieno[3,4-d]pyridazine-1-carboxylate, ethyl 5-(furan-2-amido)-3-(4-methoxyphenyl)-4-oxo-3H,4H-thieno[3,4-d]pyridazine-1-carboxylate
| Molecular Formula | C21H17N3O6S |
|---|---|
| Molecular Weight | 439.08 g/mol |
| LogP | 3.4778 |
| Topological Polar Surface Area | 112.66 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 439.0838 |
| Heavy Atoms | 31 |
| Complexity | 1305.6422 |
Chemical Identifiers
| CAS Number | 851977-72-5 |
|---|---|
| SMILES | CCOC(=O)C1=NN(C(=O)C2=C(SC=C21)NC(=O)C3=CC=CO3)C4=CC=C(C=C4)OC |
Product Overview
AB00411520-02 (CAS 851977-72-5), with molecular formula C21H17N3O6S and molecular weight 439.08 g/mol. IUPAC: ethyl 5-(furan-2-carbonylamino)-3-(4-methoxyphenyl)-4-oxothieno[3,4-d]pyridazine-1-carboxylate.
Chemical Property Profile of AB00411520-02
Property Insights of AB00411520-02
The XLogP value of 3.4778 indicates that AB00411520-02 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.66 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00411520-02. Following Lipinski's Rule of Five, AB00411520-02 has 1 hydrogen bond donor(s) and 8 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 AB00411520-02?
The CAS number of AB00411520-02 is 851977-72-5.
What is the molecular formula of AB00411520-02?
The molecular formula of AB00411520-02 is C21H17N3O6S.
What is the molecular weight of AB00411520-02?
The molecular weight of AB00411520-02 is 439.08 g/mol.
Where can I buy AB00411520-02?
You can request a quote for AB00411520-02 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00411520-02?
Yes, KEHONG BIO provides custom synthesis services for AB00411520-02 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.