AN-988/15291070
TL;DR: AN-988/15291070 (CAS 443636-49-5) is a chemical compound with molecular formula C26H25N5O3S and molecular weight 487.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-[5-[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]phenyl]-2-methylbenzamide
Also Known As: AN-988/15291070, N-[3-(5-{[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)phenyl]-2-methylbenzamide, N-[3-[5-[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]phenyl]-2-methylbenzamide, N-(3-(5-((2-((4-methoxyphenyl)amino)-2-oxoethyl)thio)-4-methyl-4H-1,2,4-triazol-3-yl)phenyl)-2-methylbenzamide, N-{3-[5-({2-[(4-methoxyphenyl)amino]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]phenyl}-2-methylbenzamide
| Molecular Formula | C26H25N5O3S |
|---|---|
| Molecular Weight | 487.17 g/mol |
| LogP | 4.78222 |
| Topological Polar Surface Area | 98.14 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 487.16782 |
| Heavy Atoms | 35 |
| Complexity | 1351.3668 |
Chemical Identifiers
| CAS Number | 443636-49-5 |
|---|---|
| SMILES | CC1=CC=CC=C1C(=O)NC2=CC=CC(=C2)C3=NN=C(N3C)SCC(=O)NC4=CC=C(C=C4)OC |
Product Overview
AN-988/15291070 (CAS 443636-49-5), with molecular formula C26H25N5O3S and molecular weight 487.17 g/mol. IUPAC: N-[3-[5-[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]phenyl]-2-methylbenzamide.
Chemical Property Profile of AN-988/15291070
Property Insights of AN-988/15291070
The XLogP value of 4.78222 indicates that AN-988/15291070 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.14 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-988/15291070. Following Lipinski's Rule of Five, AN-988/15291070 has 2 hydrogen bond donor(s) and 6 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-988/15291070?
The CAS number of AN-988/15291070 is 443636-49-5.
What is the molecular formula of AN-988/15291070?
The molecular formula of AN-988/15291070 is C26H25N5O3S.
What is the molecular weight of AN-988/15291070?
The molecular weight of AN-988/15291070 is 487.17 g/mol.
Where can I buy AN-988/15291070?
You can request a quote for AN-988/15291070 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-988/15291070?
Yes, KEHONG BIO provides custom synthesis services for AN-988/15291070 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.