AN-698/41761681
TL;DR: AN-698/41761681 (CAS 665016-98-8) is a chemical compound with molecular formula C20H24N6O3S2 and molecular weight 460.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-ethyl-5-[2-[(5-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-2-(4-methoxyphenyl)acetamide
Also Known As: AN-698/41761681, 2-{[4-ethyl-5-({[(4-methoxyphenyl)acetyl]amino}methyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(5-methyl-1,3-thiazol-2-yl)acetamide, N-[[4-ethyl-5-[2-[(5-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-2-(4-methoxyphenyl)acetamide, N-{[4-ETHYL-5-({[(5-METHYL-1,3-THIAZOL-2-YL)CARBAMOYL]METHYL}SULFANYL)-1,2,4-TRIAZOL-3-YL]METHYL}-2-(4-METHOXYPHENYL)ACETAMIDE
| Molecular Formula | C20H24N6O3S2 |
|---|---|
| Molecular Weight | 460.14 g/mol |
| LogP | 2.66122 |
| Topological Polar Surface Area | 111.03 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 460.13513 |
| Heavy Atoms | 31 |
| Complexity | 1031.9722 |
Chemical Identifiers
| CAS Number | 665016-98-8 |
|---|---|
| SMILES | CCN1C(=NN=C1SCC(=O)NC2=NC=C(S2)C)CNC(=O)CC3=CC=C(C=C3)OC |
Product Overview
AN-698/41761681 (CAS 665016-98-8), with molecular formula C20H24N6O3S2 and molecular weight 460.14 g/mol. IUPAC: N-[[4-ethyl-5-[2-[(5-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-2-(4-methoxyphenyl)acetamide.
Chemical Property Profile of AN-698/41761681
Property Insights of AN-698/41761681
The XLogP value of 2.66122 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AN-698/41761681. The TPSA of 111.03 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-698/41761681. Following Lipinski's Rule of Five, AN-698/41761681 has 2 hydrogen bond donor(s) and 8 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-698/41761681?
The CAS number of AN-698/41761681 is 665016-98-8.
What is the molecular formula of AN-698/41761681?
The molecular formula of AN-698/41761681 is C20H24N6O3S2.
What is the molecular weight of AN-698/41761681?
The molecular weight of AN-698/41761681 is 460.14 g/mol.
Where can I buy AN-698/41761681?
You can request a quote for AN-698/41761681 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-698/41761681?
Yes, KEHONG BIO provides custom synthesis services for AN-698/41761681 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.