AN-648/15098033
TL;DR: AN-648/15098033 (CAS 445421-70-5) is a chemical compound with molecular formula C23H29N7O2S2 and molecular weight 499.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[6-[[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-benzothiazol-2-yl]sulfanyl]acetate
Also Known As: AN-648/15098033, methyl [(6-{[4,6-di(1-piperidinyl)-1,3,5-triazin-2-yl]amino}-1,3-benzothiazol-2-yl)sulfanyl]acetate, methyl 2-[[6-[[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-benzothiazol-2-yl]sulfanyl]acetate, methyl [(6-{[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]amino}-1,3-benzothiazol-2-yl)sulfanyl]acetate, methyl 2-((6-((4,6-di(piperidin-1-yl)-1,3,5-triazin-2(5H)-ylidene)amino)benzo[d]thiazol-2-yl)thio)acetate
| Molecular Formula | C23H29N7O2S2 |
|---|---|
| Molecular Weight | 499.18 g/mol |
| LogP | 4.4706 |
| Topological Polar Surface Area | 96.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 7 |
| Exact Mass | 499.1824 |
| Heavy Atoms | 34 |
| Complexity | 1107.2991 |
Chemical Identifiers
| CAS Number | 445421-70-5 |
|---|---|
| SMILES | COC(=O)CSC1=NC2=C(S1)C=C(C=C2)NC3=NC(=NC(=N3)N4CCCCC4)N5CCCCC5 |
Product Overview
AN-648/15098033 (CAS 445421-70-5), with molecular formula C23H29N7O2S2 and molecular weight 499.18 g/mol. IUPAC: methyl 2-[[6-[[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-benzothiazol-2-yl]sulfanyl]acetate.
Chemical Property Profile of AN-648/15098033
Property Insights of AN-648/15098033
The XLogP value of 4.4706 indicates that AN-648/15098033 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.37 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-648/15098033. Following Lipinski's Rule of Five, AN-648/15098033 has 1 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-648/15098033?
The CAS number of AN-648/15098033 is 445421-70-5.
What is the molecular formula of AN-648/15098033?
The molecular formula of AN-648/15098033 is C23H29N7O2S2.
What is the molecular weight of AN-648/15098033?
The molecular weight of AN-648/15098033 is 499.18 g/mol.
Where can I buy AN-648/15098033?
You can request a quote for AN-648/15098033 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-648/15098033?
Yes, KEHONG BIO provides custom synthesis services for AN-648/15098033 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.