AN-648/15240069
TL;DR: AN-648/15240069 (CAS 425678-19-9) is a chemical compound with molecular formula C20H18N6O3S3 and molecular weight 486.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[6-[[2-(1-benzyltetrazol-5-yl)sulfanylacetyl]amino]-1,3-benzothiazol-2-yl]sulfanyl]acetate
Also Known As: AN-648/15240069, methyl {[6-({[(1-benzyl-1H-tetraazol-5-yl)sulfanyl]acetyl}amino)-1,3-benzothiazol-2-yl]sulfanyl}acetate, methyl 2-[[6-[[2-(1-benzyltetrazol-5-yl)sulfanylacetyl]amino]-1,3-benzothiazol-2-yl]sulfanyl]acetate, methyl 2-((6-(2-((1-benzyl-1H-tetrazol-5-yl)thio)acetamido)benzo[d]thiazol-2-yl)thio)acetate
| Molecular Formula | C20H18N6O3S3 |
|---|---|
| Molecular Weight | 486.06 g/mol |
| LogP | 3.327 |
| Topological Polar Surface Area | 111.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 9 |
| Exact Mass | 486.06024 |
| Heavy Atoms | 32 |
| Complexity | 1227.791 |
Chemical Identifiers
| CAS Number | 425678-19-9 |
|---|---|
| SMILES | COC(=O)CSC1=NC2=C(S1)C=C(C=C2)NC(=O)CSC3=NN=NN3CC4=CC=CC=C4 |
Product Overview
AN-648/15240069 (CAS 425678-19-9), with molecular formula C20H18N6O3S3 and molecular weight 486.06 g/mol. IUPAC: methyl 2-[[6-[[2-(1-benzyltetrazol-5-yl)sulfanylacetyl]amino]-1,3-benzothiazol-2-yl]sulfanyl]acetate.
Chemical Property Profile of AN-648/15240069
Property Insights of AN-648/15240069
The XLogP value of 3.327 indicates that AN-648/15240069 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.89 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-648/15240069. Following Lipinski's Rule of Five, AN-648/15240069 has 1 hydrogen bond donor(s) and 10 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 AN-648/15240069?
The CAS number of AN-648/15240069 is 425678-19-9.
What is the molecular formula of AN-648/15240069?
The molecular formula of AN-648/15240069 is C20H18N6O3S3.
What is the molecular weight of AN-648/15240069?
The molecular weight of AN-648/15240069 is 486.06 g/mol.
Where can I buy AN-648/15240069?
You can request a quote for AN-648/15240069 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-648/15240069?
Yes, KEHONG BIO provides custom synthesis services for AN-648/15240069 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.