BAS 06988731
TL;DR: BAS 06988731 (CAS 577791-75-4) is a chemical compound with molecular formula C23H20N4O4 and molecular weight 416.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-(3,4-dimethoxyphenyl)-12,14-dimethyl-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 06988731, BRD-K79518387-001-01-3, A3379/0143364, 6-(3,4-dimethoxyphenyl)-7,9-dimethylpyrimido[4',5':3,4]pyrrolo[1,2-a]quinoxaline-8,10(7H,9H)-dione
| Molecular Formula | C23H20N4O4 |
|---|---|
| Molecular Weight | 416.15 g/mol |
| LogP | 2.7223 |
| Topological Polar Surface Area | 79.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 416.14847 |
| Heavy Atoms | 31 |
| Complexity | 1625.1306 |
Chemical Identifiers
| CAS Number | 577791-75-4 |
|---|---|
| SMILES | CN1C2=C3C(=NC4=CC=CC=C4N3C=C2C(=O)N(C1=O)C)C5=CC(=C(C=C5)OC)OC |
Product Overview
BAS 06988731 (CAS 577791-75-4), with molecular formula C23H20N4O4 and molecular weight 416.15 g/mol. IUPAC: 9-(3,4-dimethoxyphenyl)-12,14-dimethyl-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 06988731
Property Insights of BAS 06988731
The XLogP value of 2.7223 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 06988731. The TPSA of 79.76 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 06988731. Following Lipinski's Rule of Five, BAS 06988731 has 0 hydrogen bond donor(s) and 5 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 06988731?
The CAS number of BAS 06988731 is 577791-75-4.
What is the molecular formula of BAS 06988731?
The molecular formula of BAS 06988731 is C23H20N4O4.
What is the molecular weight of BAS 06988731?
The molecular weight of BAS 06988731 is 416.15 g/mol.
Where can I buy BAS 06988731?
You can request a quote for BAS 06988731 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 06988731?
Yes, KEHONG BIO provides custom synthesis services for BAS 06988731 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.