AO-080/42479759
TL;DR: AO-080/42479759 (CAS 632301-47-4) is a chemical compound with molecular formula C19H20N4O2S and molecular weight 368.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-2-[[5-[hydroxy(phenyl)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: AO-080/42479759, A3202/0135733, N-benzyl-2-[[5-[hydroxy(phenyl)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide, N-benzyl-2-({5-[hydroxy(phenyl)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide, N~1~-BENZYL-2-({5-[HYDROXY(PHENYL)METHYL]-4-METHYL-4H-1,2,4-TRIAZOL-3-YL}SULFANYL)ACETAMIDE
| Molecular Formula | C19H20N4O2S |
|---|---|
| Molecular Weight | 368.13 g/mol |
| LogP | 2.3053 |
| Topological Polar Surface Area | 80.04 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 368.1307 |
| Heavy Atoms | 26 |
| Complexity | 852.49036 |
Chemical Identifiers
| CAS Number | 632301-47-4 |
|---|---|
| SMILES | CN1C(=NN=C1SCC(=O)NCC2=CC=CC=C2)C(C3=CC=CC=C3)O |
Product Overview
AO-080/42479759 (CAS 632301-47-4), with molecular formula C19H20N4O2S and molecular weight 368.13 g/mol. IUPAC: N-benzyl-2-[[5-[hydroxy(phenyl)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide.
Chemical Property Profile of AO-080/42479759
Property Insights of AO-080/42479759
The XLogP value of 2.3053 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AO-080/42479759. The TPSA of 80.04 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-080/42479759. Following Lipinski's Rule of Five, AO-080/42479759 has 2 hydrogen bond donor(s) and 5 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 AO-080/42479759?
The CAS number of AO-080/42479759 is 632301-47-4.
What is the molecular formula of AO-080/42479759?
The molecular formula of AO-080/42479759 is C19H20N4O2S.
What is the molecular weight of AO-080/42479759?
The molecular weight of AO-080/42479759 is 368.13 g/mol.
Where can I buy AO-080/42479759?
You can request a quote for AO-080/42479759 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-080/42479759?
Yes, KEHONG BIO provides custom synthesis services for AO-080/42479759 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.