SK&F 21681
TL;DR: SK&F 21681 (CAS 4349-84-2) is a chemical compound with molecular formula C12H10N6 and molecular weight 238.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8,14-dimethyl-8,10,12,13,15,16-hexazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(16),2,4,6,9,11,13-heptaene
Also Known As: dimethyl[?], Skf 21681, J1.239.805K, 10H-1,2,4-Triazolo[4',3':2,3][1,2,4]triazino[5,6-b]indole, 3,10-dimethyl-, 10H-1,2,4-Triazolo(4',3':2,3)(1,2,4)triazino(5,6-b)indole, 3,10-dimethyl-
| Molecular Formula | C12H10N6 |
|---|---|
| Molecular Weight | 238.10 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 60.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 238.0967 |
| Heavy Atoms | 18 |
| Complexity | 337.0 |
Chemical Identifiers
| CAS Number | 4349-84-2 |
|---|---|
| SMILES | CC1=NN=C2N1N=C3C4=CC=CC=C4N(C3=N2)C |
| InChIKey | UXHOLPARXQTOFH-UHFFFAOYSA-N |
Product Overview
SK&F 21681 (CAS 4349-84-2), with molecular formula C12H10N6 and molecular weight 238.10 g/mol. IUPAC: 8,14-dimethyl-8,10,12,13,15,16-hexazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(16),2,4,6,9,11,13-heptaene.
Chemical Property Profile of SK&F 21681
Property Insights of SK&F 21681
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for SK&F 21681. The TPSA of 60.9 Ų falls within the moderate polarity range, balancing permeability and solubility for SK&F 21681. Following Lipinski's Rule of Five, SK&F 21681 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 SK&F 21681?
The CAS number of SK&F 21681 is 4349-84-2.
What is the molecular formula of SK&F 21681?
The molecular formula of SK&F 21681 is C12H10N6.
What is the molecular weight of SK&F 21681?
The molecular weight of SK&F 21681 is 238.10 g/mol.
Where can I buy SK&F 21681?
You can request a quote for SK&F 21681 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for SK&F 21681?
Yes, KEHONG BIO provides custom synthesis services for SK&F 21681 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.