3-ethyl 5,6-dimethyl 2-aminothieno[2,3-d]pyridazine-3,5,6(4H,7H)-tricarboxylate
TL;DR: 3-ethyl 5,6-dimethyl 2-aminothieno[2,3-d]pyridazine-3,5,6(4H,7H)-tricarboxylate (CAS 132574-11-9) is a chemical compound with molecular formula C13H17N3O6S and molecular weight 343.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-O-ethyl 5-O,6-O-dimethyl 2-amino-4,7-dihydrothieno[2,3-d]pyridazine-3,5,6-tricarboxylate
Also Known As: BAS 02972858, BRD-K80772893-001-01-0, 3-ethyl 5,6-dimethyl 2-aminothieno[2,3-d]pyridazine-3,5,6(4H,7H)-tricarboxylate, 3-O-ethyl 5-O,6-O-dimethyl 2-amino-4,7-dihydrothieno[2,3-d]pyridazine-3,5,6-tricarboxylate, methyl 2-amino-3-(ethoxycarbonyl)-5-(methoxycarbonyl)-4,5,6,7-tetrahydrothioph eno[3,2-d]pyridazine-6-carboxylate
| Molecular Formula | C13H17N3O6S |
|---|---|
| Molecular Weight | 343.08 g/mol |
| LogP | 1.5724 |
| Topological Polar Surface Area | 111.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 343.0838 |
| Heavy Atoms | 23 |
| Complexity | 643.89954 |
Chemical Identifiers
| CAS Number | 132574-11-9 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CN(N(C2)C(=O)OC)C(=O)OC)N |
Product Overview
3-ethyl 5,6-dimethyl 2-aminothieno[2,3-d]pyridazine-3,5,6(4H,7H)-tricarboxylate (CAS 132574-11-9), with molecular formula C13H17N3O6S and molecular weight 343.08 g/mol. IUPAC: 3-O-ethyl 5-O,6-O-dimethyl 2-amino-4,7-dihydrothieno[2,3-d]pyridazine-3,5,6-tricarboxylate.
Chemical Property Profile of 3-ethyl 5,6-dimethyl 2-aminothieno[2,3-d]pyridazine-3,5,6(4H,7H)-tricarboxylate
Property Insights of 3-ethyl 5,6-dimethyl 2-aminothieno[2,3-d]pyridazine-3,5,6(4H,7H)-tricarboxylate
The XLogP value of 1.5724 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-ethyl 5,6-dimethyl 2-aminothieno[2,3-d]pyridazine-3,5,6(4H,7H)-tricarboxylate. The TPSA of 111.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-ethyl 5,6-dimethyl 2-aminothieno[2,3-d]pyridazine-3,5,6(4H,7H)-tricarboxylate. Following Lipinski's Rule of Five, 3-ethyl 5,6-dimethyl 2-aminothieno[2,3-d]pyridazine-3,5,6(4H,7H)-tricarboxylate 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 3-ethyl 5,6-dimethyl 2-aminothieno[2,3-d]pyridazine-3,5,6(4H,7H)-tricarboxylate?
The CAS number of 3-ethyl 5,6-dimethyl 2-aminothieno[2,3-d]pyridazine-3,5,6(4H,7H)-tricarboxylate is 132574-11-9.
What is the molecular formula of 3-ethyl 5,6-dimethyl 2-aminothieno[2,3-d]pyridazine-3,5,6(4H,7H)-tricarboxylate?
The molecular formula of 3-ethyl 5,6-dimethyl 2-aminothieno[2,3-d]pyridazine-3,5,6(4H,7H)-tricarboxylate is C13H17N3O6S.
What is the molecular weight of 3-ethyl 5,6-dimethyl 2-aminothieno[2,3-d]pyridazine-3,5,6(4H,7H)-tricarboxylate?
The molecular weight of 3-ethyl 5,6-dimethyl 2-aminothieno[2,3-d]pyridazine-3,5,6(4H,7H)-tricarboxylate is 343.08 g/mol.
Where can I buy 3-ethyl 5,6-dimethyl 2-aminothieno[2,3-d]pyridazine-3,5,6(4H,7H)-tricarboxylate?
You can request a quote for 3-ethyl 5,6-dimethyl 2-aminothieno[2,3-d]pyridazine-3,5,6(4H,7H)-tricarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-ethyl 5,6-dimethyl 2-aminothieno[2,3-d]pyridazine-3,5,6(4H,7H)-tricarboxylate?
Yes, KEHONG BIO provides custom synthesis services for 3-ethyl 5,6-dimethyl 2-aminothieno[2,3-d]pyridazine-3,5,6(4H,7H)-tricarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.