C19H19N9O5S2
TL;DR: C19H19N9O5S2 (CAS 843636-26-0) is a chemical compound with molecular formula C19H19N9O5S2 and molecular weight 517.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(E)-[[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)triazole-4-carbonyl]hydrazinylidene]methyl]-2-methoxyphenyl] acetate
Also Known As: (E)-4-((2-(1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(((4,5-dihydrothiazol-2-yl)thio)methyl)-1H-1,2,3-triazole-4-carbonyl)hydrazono)methyl)-2-methoxyphenyl acetate, 4-{(E)-[2-({1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)methyl]-1H-1,2,3-triazol-4-yl}carbonyl)hydrazinylidene]methyl}-2-methoxyphenyl acetate
| Molecular Formula | C19H19N9O5S2 |
|---|---|
| Molecular Weight | 517.10 g/mol |
| LogP | 1.2663 |
| Topological Polar Surface Area | 185.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 8 |
| Exact Mass | 517.09503 |
| Heavy Atoms | 35 |
| Complexity | 1303.6217 |
Chemical Identifiers
| CAS Number | 843636-26-0 |
|---|---|
| SMILES | CC(=O)OC1=C(C=C(C=C1)/C=N/NC(=O)C2=C(N(N=N2)C3=NON=C3N)CSC4=NCCS4)OC |
Product Overview
C19H19N9O5S2 (CAS 843636-26-0), with molecular formula C19H19N9O5S2 and molecular weight 517.10 g/mol. IUPAC: [4-[(E)-[[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)triazole-4-carbonyl]hydrazinylidene]methyl]-2-methoxyphenyl] acetate.
Chemical Property Profile of C19H19N9O5S2
Property Insights of C19H19N9O5S2
The XLogP value of 1.2663 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C19H19N9O5S2. The TPSA of 185.0 Ų indicates high polarity, suggesting C19H19N9O5S2 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, C19H19N9O5S2 has 2 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C19H19N9O5S2?
The CAS number of C19H19N9O5S2 is 843636-26-0.
What is the molecular formula of C19H19N9O5S2?
The molecular formula of C19H19N9O5S2 is C19H19N9O5S2.
What is the molecular weight of C19H19N9O5S2?
The molecular weight of C19H19N9O5S2 is 517.10 g/mol.
Where can I buy C19H19N9O5S2?
You can request a quote for C19H19N9O5S2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C19H19N9O5S2?
Yes, KEHONG BIO provides custom synthesis services for C19H19N9O5S2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.