BAS 06988726
TL;DR: BAS 06988726 (CAS 573697-84-4) is a chemical compound with molecular formula C16H11F3N4O2 and molecular weight 348.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
12,14-dimethyl-9-(trifluoromethyl)-1,8,12,14-tetrazatetracyclo[8.7.0.02,7.011,16]heptadeca-2,4,6,8,10,16-hexaene-13,15-dione
Also Known As: BAS 06988726, 7,9-dimethyl-6-(trifluoromethyl)pyrimido[4',5':3,4]pyrrolo[1,2-a]quinoxaline-8,10(7H,9H)-dione, A3366/0142942, 7,9-dimethyl-6-(trifluoromethyl)-7,9,12-trihydroquinoxalino[1',2'-2,1]pyrrolo[ 3,4-d]pyrimidine-8,10-dione
| Molecular Formula | C16H11F3N4O2 |
|---|---|
| Molecular Weight | 348.08 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 57.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 348.0834 |
| Heavy Atoms | 25 |
| Complexity | 598.0 |
Chemical Identifiers
| CAS Number | 573697-84-4 |
|---|---|
| SMILES | CN1C2=C3C(=NC4=CC=CC=C4N3C=C2C(=O)N(C1=O)C)C(F)(F)F |
| InChIKey | FIHPHWYLVGOLIR-UHFFFAOYSA-N |
Product Overview
BAS 06988726 (CAS 573697-84-4), with molecular formula C16H11F3N4O2 and molecular weight 348.08 g/mol. IUPAC: 12,14-dimethyl-9-(trifluoromethyl)-1,8,12,14-tetrazatetracyclo[8.7.0.02,7.011,16]heptadeca-2,4,6,8,10,16-hexaene-13,15-dione.
Chemical Property Profile of BAS 06988726
Property Insights of BAS 06988726
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 06988726. With a topological polar surface area (TPSA) of 57.9 Ų, BAS 06988726 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 06988726 has 0 hydrogen bond donor(s) and 6 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 BAS 06988726?
The CAS number of BAS 06988726 is 573697-84-4.
What is the molecular formula of BAS 06988726?
The molecular formula of BAS 06988726 is C16H11F3N4O2.
What is the molecular weight of BAS 06988726?
The molecular weight of BAS 06988726 is 348.08 g/mol.
Where can I buy BAS 06988726?
You can request a quote for BAS 06988726 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 06988726?
Yes, KEHONG BIO provides custom synthesis services for BAS 06988726 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.