AN-329/40484266
TL;DR: AN-329/40484266 (CAS 314759-33-6) is a chemical compound with molecular formula C21H16N6O2S and molecular weight 416.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-5-methyl-3-oxo-1H-pyrazol-4-yl]diazenyl]benzonitrile
Also Known As: AN-329/40484266, 3-(2-{1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene}hydrazino)benzonitrile, 3-[(2E)-2-[1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-methyl-5-oxopyrazol-4-ylidene]hydrazinyl]benzonitrile, 3-[(2E)-2-{1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene}hydrazinyl]benzonitrile, 3-[(2Z)-2-[1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-methyl-5-oxopyrazol-4-ylidene]hydrazinyl]benzonitrile
| Molecular Formula | C21H16N6O2S |
|---|---|
| Molecular Weight | 416.11 g/mol |
| LogP | 4.8932 |
| Topological Polar Surface Area | 108.42 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 416.10553 |
| Heavy Atoms | 30 |
| Complexity | 1324.7783 |
Chemical Identifiers
| CAS Number | 314759-33-6 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1)C2=NC(=CS2)C3=CC=C(C=C3)OC)N=NC4=CC=CC(=C4)C#N |
Product Overview
AN-329/40484266 (CAS 314759-33-6), with molecular formula C21H16N6O2S and molecular weight 416.11 g/mol. IUPAC: 3-[[2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-5-methyl-3-oxo-1H-pyrazol-4-yl]diazenyl]benzonitrile.
Chemical Property Profile of AN-329/40484266
Property Insights of AN-329/40484266
The XLogP value of 4.8932 indicates that AN-329/40484266 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.42 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-329/40484266. Following Lipinski's Rule of Five, AN-329/40484266 has 1 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 AN-329/40484266?
The CAS number of AN-329/40484266 is 314759-33-6.
What is the molecular formula of AN-329/40484266?
The molecular formula of AN-329/40484266 is C21H16N6O2S.
What is the molecular weight of AN-329/40484266?
The molecular weight of AN-329/40484266 is 416.11 g/mol.
Where can I buy AN-329/40484266?
You can request a quote for AN-329/40484266 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-329/40484266?
Yes, KEHONG BIO provides custom synthesis services for AN-329/40484266 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.