2-Azetidinone,4-benzoyl-3,3-dichloro-1,4-diphenyl
TL;DR: 2-Azetidinone,4-benzoyl-3,3-dichloro-1,4-diphenyl (CAS 577998-44-8) is a chemical compound with molecular formula C26H26N6O3S2 and molecular weight 534.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methoxydibenzofuran-3-yl)acetamide
Also Known As: 2-Azetidinone,4-benzoyl-3,3-dichloro-1,4-diphenyl, 2-[(5-{[(4,6-Dimethyl-2-pyrimidinyl)sulfanyl]methyl}-4-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methoxydibenzo[b,d]furan-3-yl)acetamide, 2-[[5-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methoxydibenzofuran-3-yl)acetamide, Acetamide,2-[[5-[[ thio]methyl]-4-ethyl-4H-1,2,4-triazol-3-yl]thio]-N- -, 4-(1-((4,6-dihydroxy-13,24,33,44,53,64-hexaoxin-2-yl)peroxy)-2-hydroperoxy-2H-14,23,34,43,53-pentaoxol-3-yl)-1-(3-hydroperoxy-13,24,34,43,54,64,73,83,93,103,114,134-pentaoxola[1,2:4,3]bis(hexaoxine)-2-yl)-24-tetraoxidan-2-one
| Molecular Formula | C26H26N6O3S2 |
|---|---|
| Molecular Weight | 534.15 g/mol |
| LogP | 5.63594 |
| Topological Polar Surface Area | 107.96 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 9 |
| Exact Mass | 534.15076 |
| Heavy Atoms | 37 |
| Complexity | 1576.3452 |
Chemical Identifiers
| CAS Number | 577998-44-8 |
|---|---|
| SMILES | CCN1C(=NN=C1SCC(=O)NC2=C(C=C3C4=CC=CC=C4OC3=C2)OC)CSC5=NC(=CC(=N5)C)C |
Product Overview
2-Azetidinone,4-benzoyl-3,3-dichloro-1,4-diphenyl (CAS 577998-44-8), with molecular formula C26H26N6O3S2 and molecular weight 534.15 g/mol. IUPAC: 2-[[5-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methoxydibenzofuran-3-yl)acetamide.
Chemical Property Profile of 2-Azetidinone,4-benzoyl-3,3-dichloro-1,4-diphenyl
Property Insights of 2-Azetidinone,4-benzoyl-3,3-dichloro-1,4-diphenyl
The XLogP value of 5.63594 indicates that 2-Azetidinone,4-benzoyl-3,3-dichloro-1,4-diphenyl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.96 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Azetidinone,4-benzoyl-3,3-dichloro-1,4-diphenyl. Following Lipinski's Rule of Five, 2-Azetidinone,4-benzoyl-3,3-dichloro-1,4-diphenyl has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Azetidinone,4-benzoyl-3,3-dichloro-1,4-diphenyl?
The CAS number of 2-Azetidinone,4-benzoyl-3,3-dichloro-1,4-diphenyl is 577998-44-8.
What is the molecular formula of 2-Azetidinone,4-benzoyl-3,3-dichloro-1,4-diphenyl?
The molecular formula of 2-Azetidinone,4-benzoyl-3,3-dichloro-1,4-diphenyl is C26H26N6O3S2.
What is the molecular weight of 2-Azetidinone,4-benzoyl-3,3-dichloro-1,4-diphenyl?
The molecular weight of 2-Azetidinone,4-benzoyl-3,3-dichloro-1,4-diphenyl is 534.15 g/mol.
Where can I buy 2-Azetidinone,4-benzoyl-3,3-dichloro-1,4-diphenyl?
You can request a quote for 2-Azetidinone,4-benzoyl-3,3-dichloro-1,4-diphenyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Azetidinone,4-benzoyl-3,3-dichloro-1,4-diphenyl?
Yes, KEHONG BIO provides custom synthesis services for 2-Azetidinone,4-benzoyl-3,3-dichloro-1,4-diphenyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.