C30H34N6OS
TL;DR: C30H34N6OS (CAS 488744-53-2) is a chemical compound with molecular formula C30H34N6OS and molecular weight 526.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(4-tert-butylphenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(Z)-[4-(dimethylamino)phenyl]methylideneamino]acetamide
Also Known As: 2-[[5-(4-tert-butylphenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(Z)-(4-dimethylaminophenyl)methylideneamino]acetamide, 2-{[5-(4-tert-butylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-{(Z)-[4-(dimethylamino)phenyl]methylidene}acetohydrazide, N-{(1Z)-2-[4-(dimethylamino)phenyl]-1-azavinyl}-2-{5-[4-(tert-butyl)phenyl]-4- (4-methylphenyl)(1,2,4-triazol-3-ylthio)}acetamide
| Molecular Formula | C30H34N6OS |
|---|---|
| Molecular Weight | 526.25 g/mol |
| LogP | 5.84862 |
| Topological Polar Surface Area | 75.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 526.25146 |
| Heavy Atoms | 38 |
| Complexity | 1399.3811 |
Chemical Identifiers
| CAS Number | 488744-53-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)N/N=C\C3=CC=C(C=C3)N(C)C)C4=CC=C(C=C4)C(C)(C)C |
Product Overview
C30H34N6OS (CAS 488744-53-2), with molecular formula C30H34N6OS and molecular weight 526.25 g/mol. IUPAC: 2-[[5-(4-tert-butylphenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(Z)-[4-(dimethylamino)phenyl]methylideneamino]acetamide.
Chemical Property Profile of C30H34N6OS
Property Insights of C30H34N6OS
The XLogP value of 5.84862 indicates that C30H34N6OS is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.41 Ų falls within the moderate polarity range, balancing permeability and solubility for C30H34N6OS. Following Lipinski's Rule of Five, C30H34N6OS has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C30H34N6OS?
The CAS number of C30H34N6OS is 488744-53-2.
What is the molecular formula of C30H34N6OS?
The molecular formula of C30H34N6OS is C30H34N6OS.
What is the molecular weight of C30H34N6OS?
The molecular weight of C30H34N6OS is 526.25 g/mol.
Where can I buy C30H34N6OS?
You can request a quote for C30H34N6OS directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C30H34N6OS?
Yes, KEHONG BIO provides custom synthesis services for C30H34N6OS and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.