![N-[5-(ACETYLAMINO)-2-METHOXYPHENYL]-2-{[4-ALLYL-5-(2-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL}ACETAMIDE structure](/static/products/5777/577789-17-4.webp)
N-[5-(ACETYLAMINO)-2-METHOXYPHENYL]-2-{[4-ALLYL-5-(2-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL}ACETAMIDE
TL;DR: N-[5-(ACETYLAMINO)-2-METHOXYPHENYL]-2-{[4-ALLYL-5-(2-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL}ACETAMIDE (CAS 577789-17-4) is a chemical compound with molecular formula C21H22N6O3S and molecular weight 438.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-acetamido-2-methoxyphenyl)-2-[(4-prop-2-enyl-5-pyridin-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
Also Known As: N-[5-(ACETYLAMINO)-2-METHOXYPHENYL]-2-{[4-ALLYL-5-(2-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL}ACETAMIDE, N-(5-Acetamido-2-methoxyphenyl)-2-((4-allyl-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl)thio)acetamide, 637-448-7, N-(5-(Acetylamino)-2-methoxyphenyl)-2-((4-allyl-5-(2-pyridinyl)-4H-1,2,4-triazol-3-YL)sulfanyl)acetamide, N-(5-acetamido-2-methoxyphenyl)-2-[(4-prop-2-enyl-5-pyridin-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
| Molecular Formula | C21H22N6O3S |
|---|---|
| Molecular Weight | 438.15 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 136.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 438.1474 |
| Heavy Atoms | 31 |
| Complexity | 624.0 |
Chemical Identifiers
| CAS Number | 577789-17-4 |
|---|---|
| SMILES | CC(=O)NC1=CC(=C(C=C1)OC)NC(=O)CSC2=NN=C(N2CC=C)C3=CC=CC=N3 |
| InChIKey | RCZGJPUOHRPJKM-UHFFFAOYSA-N |
Product Overview
N-[5-(ACETYLAMINO)-2-METHOXYPHENYL]-2-{[4-ALLYL-5-(2-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL}ACETAMIDE (CAS 577789-17-4), with molecular formula C21H22N6O3S and molecular weight 438.15 g/mol. IUPAC: N-(5-acetamido-2-methoxyphenyl)-2-[(4-prop-2-enyl-5-pyridin-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide.
Chemical Property Profile of N-[5-(ACETYLAMINO)-2-METHOXYPHENYL]-2-{[4-ALLYL-5-(2-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL}ACETAMIDE
Property Insights of N-[5-(ACETYLAMINO)-2-METHOXYPHENYL]-2-{[4-ALLYL-5-(2-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL}ACETAMIDE
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[5-(ACETYLAMINO)-2-METHOXYPHENYL]-2-{[4-ALLYL-5-(2-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL}ACETAMIDE. The TPSA of 136.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[5-(ACETYLAMINO)-2-METHOXYPHENYL]-2-{[4-ALLYL-5-(2-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL}ACETAMIDE. Following Lipinski's Rule of Five, N-[5-(ACETYLAMINO)-2-METHOXYPHENYL]-2-{[4-ALLYL-5-(2-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL}ACETAMIDE has 2 hydrogen bond donor(s) and 7 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 N-[5-(ACETYLAMINO)-2-METHOXYPHENYL]-2-{[4-ALLYL-5-(2-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL}ACETAMIDE?
The CAS number of N-[5-(ACETYLAMINO)-2-METHOXYPHENYL]-2-{[4-ALLYL-5-(2-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL}ACETAMIDE is 577789-17-4.
What is the molecular formula of N-[5-(ACETYLAMINO)-2-METHOXYPHENYL]-2-{[4-ALLYL-5-(2-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL}ACETAMIDE?
The molecular formula of N-[5-(ACETYLAMINO)-2-METHOXYPHENYL]-2-{[4-ALLYL-5-(2-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL}ACETAMIDE is C21H22N6O3S.
What is the molecular weight of N-[5-(ACETYLAMINO)-2-METHOXYPHENYL]-2-{[4-ALLYL-5-(2-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL}ACETAMIDE?
The molecular weight of N-[5-(ACETYLAMINO)-2-METHOXYPHENYL]-2-{[4-ALLYL-5-(2-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL}ACETAMIDE is 438.15 g/mol.
Where can I buy N-[5-(ACETYLAMINO)-2-METHOXYPHENYL]-2-{[4-ALLYL-5-(2-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL}ACETAMIDE?
You can request a quote for N-[5-(ACETYLAMINO)-2-METHOXYPHENYL]-2-{[4-ALLYL-5-(2-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL}ACETAMIDE directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[5-(ACETYLAMINO)-2-METHOXYPHENYL]-2-{[4-ALLYL-5-(2-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL}ACETAMIDE?
Yes, KEHONG BIO provides custom synthesis services for N-[5-(ACETYLAMINO)-2-METHOXYPHENYL]-2-{[4-ALLYL-5-(2-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL}ACETAMIDE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.