A2162/0090821
TL;DR: A2162/0090821 (CAS 309290-01-5) is a chemical compound with molecular formula C25H21N5O3S and molecular weight 471.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(11E)-11-(furan-2-ylmethylidene)-4,6-dimethyl-3,7-diphenyl-10-thia-1,2,4,6,8-pentazatricyclo[7.3.0.03,7]dodec-8-ene-5,12-dione
Also Known As: A2162/0090821, (6E)-6-(furan-2-ylmethylidene)-1,3-dimethyl-3a,9a-diphenyl-3,3a,9,9a-tetrahydroimidazo[4,5-e][1,3]thiazolo[3,2-b][1,2,4]triazine-2,7(1H,6H)-dione, (E)-6-(furan-2-ylmethylene)-1,3-dimethyl-3a,9a-diphenyl-3,3a,9,9a-tetrahydroimidazo[4,5-e]thiazolo[3,2-b][1,2,4]triazine-2,7(1H,6H)-dione, 6-[(E)-1-(2-furyl)methylidene]-1,3-dimethyl-3a,9a-diphenyl-3,3a,9,9a-tetrahydroimidazo[4,5-e][1,3]thiazolo[3,2-b][1,2,4]triazine-2,7(1H,6H)-dione
| Molecular Formula | C25H21N5O3S |
|---|---|
| Molecular Weight | 471.14 g/mol |
| LogP | 2.2115 |
| Topological Polar Surface Area | 83.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 471.1365 |
| Heavy Atoms | 34 |
| Complexity | 1562.2064 |
Chemical Identifiers
| CAS Number | 309290-01-5 |
|---|---|
| SMILES | CN1C(=O)N(C2(C1(NN3C(=O)/C(=C\C4=CC=CO4)/SC3=N2)C5=CC=CC=C5)C6=CC=CC=C6)C |
Product Overview
A2162/0090821 (CAS 309290-01-5), with molecular formula C25H21N5O3S and molecular weight 471.14 g/mol. IUPAC: (11E)-11-(furan-2-ylmethylidene)-4,6-dimethyl-3,7-diphenyl-10-thia-1,2,4,6,8-pentazatricyclo[7.3.0.03,7]dodec-8-ene-5,12-dione.
Chemical Property Profile of A2162/0090821
Property Insights of A2162/0090821
The XLogP value of 2.2115 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A2162/0090821. The TPSA of 83.08 Ų falls within the moderate polarity range, balancing permeability and solubility for A2162/0090821. Following Lipinski's Rule of Five, A2162/0090821 has 1 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 A2162/0090821?
The CAS number of A2162/0090821 is 309290-01-5.
What is the molecular formula of A2162/0090821?
The molecular formula of A2162/0090821 is C25H21N5O3S.
What is the molecular weight of A2162/0090821?
The molecular weight of A2162/0090821 is 471.14 g/mol.
Where can I buy A2162/0090821?
You can request a quote for A2162/0090821 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2162/0090821?
Yes, KEHONG BIO provides custom synthesis services for A2162/0090821 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.