AN-648/15240070
TL;DR: AN-648/15240070 (CAS 428449-93-8) is a chemical compound with molecular formula C15H15N5O3S3 and molecular weight 409.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[6-[[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-1,3-benzothiazol-2-yl]sulfanyl]acetate
Also Known As: AN-648/15240070, methyl {[6-({[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}amino)-1,3-benzothiazol-2-yl]sulfanyl}acetate, methyl 2-((6-(2-((4-methyl-4H-1,2,4-triazol-3-yl)thio)acetamido)benzo[d]thiazol-2-yl)thio)acetate, methyl 2-[[6-[[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-1,3-benzothiazol-2-yl]sulfanyl]acetate
| Molecular Formula | C15H15N5O3S3 |
|---|---|
| Molecular Weight | 409.03 g/mol |
| LogP | 2.4207 |
| Topological Polar Surface Area | 99.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 409.0337 |
| Heavy Atoms | 26 |
| Complexity | 939.65466 |
Chemical Identifiers
| CAS Number | 428449-93-8 |
|---|---|
| SMILES | CN1C=NN=C1SCC(=O)NC2=CC3=C(C=C2)N=C(S3)SCC(=O)OC |
Product Overview
AN-648/15240070 (CAS 428449-93-8), with molecular formula C15H15N5O3S3 and molecular weight 409.03 g/mol. IUPAC: methyl 2-[[6-[[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-1,3-benzothiazol-2-yl]sulfanyl]acetate.
Chemical Property Profile of AN-648/15240070
Property Insights of AN-648/15240070
The XLogP value of 2.4207 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AN-648/15240070. The TPSA of 99.0 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-648/15240070. Following Lipinski's Rule of Five, AN-648/15240070 has 1 hydrogen bond donor(s) and 9 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-648/15240070?
The CAS number of AN-648/15240070 is 428449-93-8.
What is the molecular formula of AN-648/15240070?
The molecular formula of AN-648/15240070 is C15H15N5O3S3.
What is the molecular weight of AN-648/15240070?
The molecular weight of AN-648/15240070 is 409.03 g/mol.
Where can I buy AN-648/15240070?
You can request a quote for AN-648/15240070 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-648/15240070?
Yes, KEHONG BIO provides custom synthesis services for AN-648/15240070 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.