ASN 06164331
TL;DR: ASN 06164331 (CAS 606111-83-5) is a chemical compound with molecular formula C21H19N3O3S and molecular weight 393.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,4-dimethylphenyl)-2-[[5-(furan-2-yl)-4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone
Also Known As: ASN 06164331, Ethanone,1- -2-[[5- -4- -4H-1,2,4-triazol-3-yl]thio]-, 1-(2,4-dimethylphenyl)-2-[[5-(furan-2-yl)-4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone, ETHANONE, 1-(2,4-DIMETHYLPHENYL)-2-[[5-(2-FURANYL)-4-(2-FURANYLMETHYL)-4H-1,2,4-TRIAZOL-3-YL]THIO]-, Ethanone, 1-(2,4-dimethylphenyl)-2-[[5-(2-furanyl)-4-(2-furanylmethyl)-4H-1,2,4-triazol-3-yl]thio]- (9CI)
| Molecular Formula | C21H19N3O3S |
|---|---|
| Molecular Weight | 393.11 g/mol |
| LogP | 4.77124 |
| Topological Polar Surface Area | 74.06 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 393.11472 |
| Heavy Atoms | 28 |
| Complexity | 1082.5186 |
Chemical Identifiers
| CAS Number | 606111-83-5 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C(=O)CSC2=NN=C(N2CC3=CC=CO3)C4=CC=CO4)C |
Product Overview
ASN 06164331 (CAS 606111-83-5), with molecular formula C21H19N3O3S and molecular weight 393.11 g/mol. IUPAC: 1-(2,4-dimethylphenyl)-2-[[5-(furan-2-yl)-4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone.
Chemical Property Profile of ASN 06164331
Property Insights of ASN 06164331
The XLogP value of 4.77124 indicates that ASN 06164331 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.06 Ų falls within the moderate polarity range, balancing permeability and solubility for ASN 06164331. Following Lipinski's Rule of Five, ASN 06164331 has 0 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 ASN 06164331?
The CAS number of ASN 06164331 is 606111-83-5.
What is the molecular formula of ASN 06164331?
The molecular formula of ASN 06164331 is C21H19N3O3S.
What is the molecular weight of ASN 06164331?
The molecular weight of ASN 06164331 is 393.11 g/mol.
Where can I buy ASN 06164331?
You can request a quote for ASN 06164331 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ASN 06164331?
Yes, KEHONG BIO provides custom synthesis services for ASN 06164331 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.