A3128/0132322
TL;DR: A3128/0132322 (CAS 573932-59-9) is a chemical compound with molecular formula C18H16N4O3 and molecular weight 336.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-(4-methoxyphenyl)-3,5-dimethyl-3,5,9,10-tetrazatricyclo[7.4.0.02,7]trideca-1,7,10,12-tetraene-4,6-dione
Also Known As: A3128/0132322, 5-(4-methoxyphenyl)-1,3-dimethylpyrimido[4',5':3,4]pyrrolo[1,2-b]pyridazine-2,4(1H,3H)-dione, 5-(4-methoxyphenyl)-1,3-dimethylpyrimido[1,2]pyrrolo[4,5-b]pyridazine-2,4-dione
| Molecular Formula | C18H16N4O3 |
|---|---|
| Molecular Weight | 336.12 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 67.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 336.12225 |
| Heavy Atoms | 25 |
| Complexity | 548.0 |
Chemical Identifiers
| CAS Number | 573932-59-9 |
|---|---|
| SMILES | CN1C2=C3C=CC=NN3C(=C2C(=O)N(C1=O)C)C4=CC=C(C=C4)OC |
| InChIKey | BEUMTJRBOKOVDC-UHFFFAOYSA-N |
Product Overview
A3128/0132322 (CAS 573932-59-9), with molecular formula C18H16N4O3 and molecular weight 336.12 g/mol. IUPAC: 8-(4-methoxyphenyl)-3,5-dimethyl-3,5,9,10-tetrazatricyclo[7.4.0.02,7]trideca-1,7,10,12-tetraene-4,6-dione.
Chemical Property Profile of A3128/0132322
Property Insights of A3128/0132322
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A3128/0132322. The TPSA of 67.2 Ų falls within the moderate polarity range, balancing permeability and solubility for A3128/0132322. Following Lipinski's Rule of Five, A3128/0132322 has 0 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 A3128/0132322?
The CAS number of A3128/0132322 is 573932-59-9.
What is the molecular formula of A3128/0132322?
The molecular formula of A3128/0132322 is C18H16N4O3.
What is the molecular weight of A3128/0132322?
The molecular weight of A3128/0132322 is 336.12 g/mol.
Where can I buy A3128/0132322?
You can request a quote for A3128/0132322 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3128/0132322?
Yes, KEHONG BIO provides custom synthesis services for A3128/0132322 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.