AN-988/40875299
TL;DR: AN-988/40875299 (CAS 489406-02-2) is a chemical compound with molecular formula C25H28N8O2S2 and molecular weight 536.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[6-[(4,6-dipyrrolidin-1-yl-1,3,5-triazin-2-yl)amino]-1,3-benzothiazol-2-yl]sulfanyl]-N-(furan-2-ylmethyl)acetamide
Also Known As: AN-988/40875299, 2-[[6-[(4,6-dipyrrolidin-1-yl-1,3,5-triazin-2-yl)amino]-1,3-benzothiazol-2-yl]sulfanyl]-N-(furan-2-ylmethyl)acetamide, 2-((6-((4,6-Di(pyrrolidin-1-yl)-1,3,5-triazin-2-yl)amino)benzo[d]thiazol-2-yl)thio)-N-(furan-2-ylmethyl)acetamide, 2-(6-(4,6-di(pyrrolidin-1-yl)-1,3,5-triazin-2-ylamino)benzo[d]thiazol-2-ylthio)-N-(furan-2-ylmethyl)acetamide, 2-[(6-{[4,6-di(1-pyrrolidinyl)-1,3,5-triazin-2-yl]amino}-1,3-benzothiazol-2-yl)sulfanyl]-N-(2-furylmethyl)acetamide
| Molecular Formula | C25H28N8O2S2 |
|---|---|
| Molecular Weight | 536.18 g/mol |
| LogP | 4.4268 |
| Topological Polar Surface Area | 112.31 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 9 |
| Exact Mass | 536.1777 |
| Heavy Atoms | 37 |
| Complexity | 1330.2941 |
Chemical Identifiers
| CAS Number | 489406-02-2 |
|---|---|
| SMILES | C1CCN(C1)C2=NC(=NC(=N2)NC3=CC4=C(C=C3)N=C(S4)SCC(=O)NCC5=CC=CO5)N6CCCC6 |
Product Overview
AN-988/40875299 (CAS 489406-02-2), with molecular formula C25H28N8O2S2 and molecular weight 536.18 g/mol. IUPAC: 2-[[6-[(4,6-dipyrrolidin-1-yl-1,3,5-triazin-2-yl)amino]-1,3-benzothiazol-2-yl]sulfanyl]-N-(furan-2-ylmethyl)acetamide.
Chemical Property Profile of AN-988/40875299
Property Insights of AN-988/40875299
The XLogP value of 4.4268 indicates that AN-988/40875299 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.31 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-988/40875299. Following Lipinski's Rule of Five, AN-988/40875299 has 2 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AN-988/40875299?
The CAS number of AN-988/40875299 is 489406-02-2.
What is the molecular formula of AN-988/40875299?
The molecular formula of AN-988/40875299 is C25H28N8O2S2.
What is the molecular weight of AN-988/40875299?
The molecular weight of AN-988/40875299 is 536.18 g/mol.
Where can I buy AN-988/40875299?
You can request a quote for AN-988/40875299 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-988/40875299?
Yes, KEHONG BIO provides custom synthesis services for AN-988/40875299 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.