(Z)-N'-(1-acetyl-2-oxoindolin-3-ylidene)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-((phenylthio)methyl)-1H-1,2,3-triazole-4-carbohydrazide
TL;DR: (Z)-N'-(1-acetyl-2-oxoindolin-3-ylidene)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-((phenylthio)methyl)-1H-1,2,3-triazole-4-carbohydrazide (CAS 577700-11-9) is a chemical compound with molecular formula C22H17N9O4S and molecular weight 503.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1-acetyl-2-hydroxyindol-3-yl)imino-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(phenylsulfanylmethyl)triazole-4-carboxamide
Also Known As: (Z)-N'-(1-acetyl-2-oxoindolin-3-ylidene)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-((phenylthio)methyl)-1H-1,2,3-triazole-4-carbohydrazide, N'-[(3Z)-1-acetyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide, N-[(1-acetyl-2-oxoindol-3-ylidene)amino]-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(phenylsulfanylmethyl)triazole-4-carboxamide, N-[(E)-(1-acetyl-2-oxoindol-3-ylidene)amino]-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(phenylsulfanylmethyl)triazole-4-carboxamide, N-[(Z)-(1-acetyl-2-oxoindol-3-ylidene)amino]-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(phenylsulfanylmethyl)triazole-4-carboxamide
| Molecular Formula | C22H17N9O4S |
|---|---|
| Molecular Weight | 503.11 g/mol |
| LogP | 3.7693 |
| Topological Polar Surface Area | 179.67 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 6 |
| Exact Mass | 503.11243 |
| Heavy Atoms | 36 |
| Complexity | 1621.2604 |
Chemical Identifiers
| CAS Number | 577700-11-9 |
|---|---|
| SMILES | CC(=O)N1C2=CC=CC=C2C(=C1O)N=NC(=O)C3=C(N(N=N3)C4=NON=C4N)CSC5=CC=CC=C5 |
Product Overview
(Z)-N'-(1-acetyl-2-oxoindolin-3-ylidene)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-((phenylthio)methyl)-1H-1,2,3-triazole-4-carbohydrazide (CAS 577700-11-9), with molecular formula C22H17N9O4S and molecular weight 503.11 g/mol. IUPAC: N-(1-acetyl-2-hydroxyindol-3-yl)imino-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(phenylsulfanylmethyl)triazole-4-carboxamide.
Chemical Property Profile of (Z)-N'-(1-acetyl-2-oxoindolin-3-ylidene)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-((phenylthio)methyl)-1H-1,2,3-triazole-4-carbohydrazide
Property Insights of (Z)-N'-(1-acetyl-2-oxoindolin-3-ylidene)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-((phenylthio)methyl)-1H-1,2,3-triazole-4-carbohydrazide
The XLogP value of 3.7693 indicates that (Z)-N'-(1-acetyl-2-oxoindolin-3-ylidene)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-((phenylthio)methyl)-1H-1,2,3-triazole-4-carbohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 179.67 Ų indicates high polarity, suggesting (Z)-N'-(1-acetyl-2-oxoindolin-3-ylidene)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-((phenylthio)methyl)-1H-1,2,3-triazole-4-carbohydrazide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (Z)-N'-(1-acetyl-2-oxoindolin-3-ylidene)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-((phenylthio)methyl)-1H-1,2,3-triazole-4-carbohydrazide has 2 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (Z)-N'-(1-acetyl-2-oxoindolin-3-ylidene)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-((phenylthio)methyl)-1H-1,2,3-triazole-4-carbohydrazide?
The CAS number of (Z)-N'-(1-acetyl-2-oxoindolin-3-ylidene)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-((phenylthio)methyl)-1H-1,2,3-triazole-4-carbohydrazide is 577700-11-9.
What is the molecular formula of (Z)-N'-(1-acetyl-2-oxoindolin-3-ylidene)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-((phenylthio)methyl)-1H-1,2,3-triazole-4-carbohydrazide?
The molecular formula of (Z)-N'-(1-acetyl-2-oxoindolin-3-ylidene)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-((phenylthio)methyl)-1H-1,2,3-triazole-4-carbohydrazide is C22H17N9O4S.
What is the molecular weight of (Z)-N'-(1-acetyl-2-oxoindolin-3-ylidene)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-((phenylthio)methyl)-1H-1,2,3-triazole-4-carbohydrazide?
The molecular weight of (Z)-N'-(1-acetyl-2-oxoindolin-3-ylidene)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-((phenylthio)methyl)-1H-1,2,3-triazole-4-carbohydrazide is 503.11 g/mol.
Where can I buy (Z)-N'-(1-acetyl-2-oxoindolin-3-ylidene)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-((phenylthio)methyl)-1H-1,2,3-triazole-4-carbohydrazide?
You can request a quote for (Z)-N'-(1-acetyl-2-oxoindolin-3-ylidene)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-((phenylthio)methyl)-1H-1,2,3-triazole-4-carbohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-N'-(1-acetyl-2-oxoindolin-3-ylidene)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-((phenylthio)methyl)-1H-1,2,3-triazole-4-carbohydrazide?
Yes, KEHONG BIO provides custom synthesis services for (Z)-N'-(1-acetyl-2-oxoindolin-3-ylidene)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-((phenylthio)methyl)-1H-1,2,3-triazole-4-carbohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.