MixCom6_001758
TL;DR: MixCom6_001758 (CAS 306756-07-0) is a chemical compound with molecular formula C23H18N6O3S and molecular weight 458.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(E)-(2-nitrophenyl)methylideneamino]acetamide
Also Known As: MixCom6_001758, BIM-0032135.P001, 2-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N'-[(E)-(2-nitrophenyl)methylidene]acetohydrazide, 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(E)-(2-nitrophenyl)methylideneamino]acetamide, (E)-2-((4,5-diphenyl-4H-1,2,4-triazol-3-yl)thio)-N'-(2-nitrobenzylidene)acetohydrazide
| Molecular Formula | C23H18N6O3S |
|---|---|
| Molecular Weight | 458.12 g/mol |
| LogP | 4.0849 |
| Topological Polar Surface Area | 115.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 458.11612 |
| Heavy Atoms | 33 |
| Complexity | 1292.0717 |
Chemical Identifiers
| CAS Number | 306756-07-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)SCC(=O)N/N=C/C4=CC=CC=C4[N+](=O)[O-] |
Product Overview
MixCom6_001758 (CAS 306756-07-0), with molecular formula C23H18N6O3S and molecular weight 458.12 g/mol. IUPAC: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(E)-(2-nitrophenyl)methylideneamino]acetamide.
Chemical Property Profile of MixCom6_001758
Property Insights of MixCom6_001758
The XLogP value of 4.0849 indicates that MixCom6_001758 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.31 Ų falls within the moderate polarity range, balancing permeability and solubility for MixCom6_001758. Following Lipinski's Rule of Five, MixCom6_001758 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 MixCom6_001758?
The CAS number of MixCom6_001758 is 306756-07-0.
What is the molecular formula of MixCom6_001758?
The molecular formula of MixCom6_001758 is C23H18N6O3S.
What is the molecular weight of MixCom6_001758?
The molecular weight of MixCom6_001758 is 458.12 g/mol.
Where can I buy MixCom6_001758?
You can request a quote for MixCom6_001758 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for MixCom6_001758?
Yes, KEHONG BIO provides custom synthesis services for MixCom6_001758 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.