ASN 05448753
TL;DR: ASN 05448753 (CAS 338953-96-1) is a chemical compound with molecular formula C22H28N4O2S2 and molecular weight 444.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[5-[(4-tert-butylphenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]methyl]-4-methylbenzenesulfonamide
Also Known As: ASN 05448753, 5H-408S, N-[(5-{[(4-tert-butylphenyl)methyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)methyl]-4-methylbenzene-1-sulfonamide, N-[[5-[(4-tert-butylphenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]methyl]-4-methylbenzenesulfonamide, N-[(5-{[4-(tert-butyl)benzyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)methyl]-4-methylbenzenesulfonamide
| Molecular Formula | C22H28N4O2S2 |
|---|---|
| Molecular Weight | 444.17 g/mol |
| LogP | 4.19182 |
| Topological Polar Surface Area | 76.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 444.16537 |
| Heavy Atoms | 30 |
| Complexity | 1097.5344 |
Chemical Identifiers
| CAS Number | 338953-96-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NCC2=NN=C(N2C)SCC3=CC=C(C=C3)C(C)(C)C |
Product Overview
ASN 05448753 (CAS 338953-96-1), with molecular formula C22H28N4O2S2 and molecular weight 444.17 g/mol. IUPAC: N-[[5-[(4-tert-butylphenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]methyl]-4-methylbenzenesulfonamide.
Chemical Property Profile of ASN 05448753
Property Insights of ASN 05448753
The XLogP value of 4.19182 indicates that ASN 05448753 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.88 Ų falls within the moderate polarity range, balancing permeability and solubility for ASN 05448753. Following Lipinski's Rule of Five, ASN 05448753 has 1 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 ASN 05448753?
The CAS number of ASN 05448753 is 338953-96-1.
What is the molecular formula of ASN 05448753?
The molecular formula of ASN 05448753 is C22H28N4O2S2.
What is the molecular weight of ASN 05448753?
The molecular weight of ASN 05448753 is 444.17 g/mol.
Where can I buy ASN 05448753?
You can request a quote for ASN 05448753 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ASN 05448753?
Yes, KEHONG BIO provides custom synthesis services for ASN 05448753 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.