AS-871/42217366
TL;DR: AS-871/42217366 (CAS 620588-97-8) is a chemical compound with molecular formula C25H23N3O4S and molecular weight 461.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5-methyl-1,3,4-thiadiazol-2-yl)-1-(4-pentoxyphenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione
Also Known As: AS-871/42217366, 2-(5-methyl-1,3,4-thiadiazol-2-yl)-1-[4-(pentyloxy)phenyl]-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione, 2-(5-methyl-1,3,4-thiadiazol-2-yl)-1-(4-pentoxyphenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione, 2-(5-methyl-1,3,4-thiadiazol-2-yl)-1-[4-(pentyloxy)phenyl]-1H,2H,3H,9H-chromeno[2,3-c]pyrrole-3,9-dione
| Molecular Formula | C25H23N3O4S |
|---|---|
| Molecular Weight | 461.14 g/mol |
| LogP | 5.27172 |
| Topological Polar Surface Area | 85.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 461.14093 |
| Heavy Atoms | 33 |
| Complexity | 1376.6836 |
Chemical Identifiers
| CAS Number | 620588-97-8 |
|---|---|
| SMILES | CCCCCOC1=CC=C(C=C1)C2C3=C(C(=O)N2C4=NN=C(S4)C)OC5=CC=CC=C5C3=O |
Product Overview
AS-871/42217366 (CAS 620588-97-8), with molecular formula C25H23N3O4S and molecular weight 461.14 g/mol. IUPAC: 2-(5-methyl-1,3,4-thiadiazol-2-yl)-1-(4-pentoxyphenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione.
Chemical Property Profile of AS-871/42217366
Property Insights of AS-871/42217366
The XLogP value of 5.27172 indicates that AS-871/42217366 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.53 Ų falls within the moderate polarity range, balancing permeability and solubility for AS-871/42217366. Following Lipinski's Rule of Five, AS-871/42217366 has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AS-871/42217366?
The CAS number of AS-871/42217366 is 620588-97-8.
What is the molecular formula of AS-871/42217366?
The molecular formula of AS-871/42217366 is C25H23N3O4S.
What is the molecular weight of AS-871/42217366?
The molecular weight of AS-871/42217366 is 461.14 g/mol.
Where can I buy AS-871/42217366?
You can request a quote for AS-871/42217366 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AS-871/42217366?
Yes, KEHONG BIO provides custom synthesis services for AS-871/42217366 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.