AN-648/15240040
TL;DR: AN-648/15240040 (CAS 333741-75-6) is a chemical compound with molecular formula C20H22N8O2S2 and molecular weight 470.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[6-[(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)amino]-1,3-benzothiazol-2-yl]sulfanyl]acetonitrile
Also Known As: AN-648/15240040, 2-[[6-[(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)amino]-1,3-benzothiazol-2-yl]sulfanyl]acetonitrile, [(6-{[4,6-di(4-morpholinyl)-1,3,5-triazin-2-yl]amino}-1,3-benzothiazol-2-yl)sulfanyl]acetonitrile, 2-((6-((4,6-dimorpholino-1,3,5-triazin-2-yl)amino)benzo[d]thiazol-2-yl)thio)acetonitrile, 2-{6-[(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)amino]benzothiazol-2-ylthio}eth anenitrile
| Molecular Formula | C20H22N8O2S2 |
|---|---|
| Molecular Weight | 470.13 g/mol |
| LogP | 2.51378 |
| Topological Polar Surface Area | 112.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 6 |
| Exact Mass | 470.1307 |
| Heavy Atoms | 32 |
| Complexity | 1086.2255 |
Chemical Identifiers
| CAS Number | 333741-75-6 |
|---|---|
| SMILES | C1COCCN1C2=NC(=NC(=N2)NC3=CC4=C(C=C3)N=C(S4)SCC#N)N5CCOCC5 |
Product Overview
AN-648/15240040 (CAS 333741-75-6), with molecular formula C20H22N8O2S2 and molecular weight 470.13 g/mol. IUPAC: 2-[[6-[(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)amino]-1,3-benzothiazol-2-yl]sulfanyl]acetonitrile.
Chemical Property Profile of AN-648/15240040
Property Insights of AN-648/15240040
The XLogP value of 2.51378 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AN-648/15240040. The TPSA of 112.32 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-648/15240040. Following Lipinski's Rule of Five, AN-648/15240040 has 1 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AN-648/15240040?
The CAS number of AN-648/15240040 is 333741-75-6.
What is the molecular formula of AN-648/15240040?
The molecular formula of AN-648/15240040 is C20H22N8O2S2.
What is the molecular weight of AN-648/15240040?
The molecular weight of AN-648/15240040 is 470.13 g/mol.
Where can I buy AN-648/15240040?
You can request a quote for AN-648/15240040 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-648/15240040?
Yes, KEHONG BIO provides custom synthesis services for AN-648/15240040 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.