(E)-2-(3-methyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)-N'-(5-methyl-2-oxoindolin-3-ylidene)acetohydrazide
TL;DR: (E)-2-(3-methyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)-N'-(5-methyl-2-oxoindolin-3-ylidene)acetohydrazide (CAS 102838-56-2) is a chemical compound with molecular formula C17H15N7O4 and molecular weight 381.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2-hydroxy-5-methyl-1H-indol-3-yl)imino]-2-(3-methyl-2,6-dioxopurin-7-yl)acetamide
Also Known As: (E)-2-(3-methyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)-N'-(5-methyl-2-oxoindolin-3-ylidene)acetohydrazide, 2-(3-methyl-2,6-dioxo-purin-7-yl)-N'-(5-methyl-2-oxo-indol-3-yl)acetohydrazide, 2-(3-methyl-2,6-dioxopurin-7-yl)-N'-(5-methyl-2-oxoindol-3-yl)acetohydrazide
| Molecular Formula | C17H15N7O4 |
|---|---|
| Molecular Weight | 381.12 g/mol |
| LogP | 1.22912 |
| Topological Polar Surface Area | 150.49 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 381.11856 |
| Heavy Atoms | 28 |
| Complexity | 1386.5197 |
Chemical Identifiers
| CAS Number | 102838-56-2 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)NC(=C2N=NC(=O)CN3C=NC4=C3C(=O)NC(=O)N4C)O |
Product Overview
(E)-2-(3-methyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)-N'-(5-methyl-2-oxoindolin-3-ylidene)acetohydrazide (CAS 102838-56-2), with molecular formula C17H15N7O4 and molecular weight 381.12 g/mol. IUPAC: N-[(2-hydroxy-5-methyl-1H-indol-3-yl)imino]-2-(3-methyl-2,6-dioxopurin-7-yl)acetamide.
Chemical Property Profile of (E)-2-(3-methyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)-N'-(5-methyl-2-oxoindolin-3-ylidene)acetohydrazide
Property Insights of (E)-2-(3-methyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)-N'-(5-methyl-2-oxoindolin-3-ylidene)acetohydrazide
The XLogP value of 1.22912 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-2-(3-methyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)-N'-(5-methyl-2-oxoindolin-3-ylidene)acetohydrazide. The TPSA of 150.49 Ų indicates high polarity, suggesting (E)-2-(3-methyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)-N'-(5-methyl-2-oxoindolin-3-ylidene)acetohydrazide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (E)-2-(3-methyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)-N'-(5-methyl-2-oxoindolin-3-ylidene)acetohydrazide has 3 hydrogen bond donor(s) and 6 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 (E)-2-(3-methyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)-N'-(5-methyl-2-oxoindolin-3-ylidene)acetohydrazide?
The CAS number of (E)-2-(3-methyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)-N'-(5-methyl-2-oxoindolin-3-ylidene)acetohydrazide is 102838-56-2.
What is the molecular formula of (E)-2-(3-methyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)-N'-(5-methyl-2-oxoindolin-3-ylidene)acetohydrazide?
The molecular formula of (E)-2-(3-methyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)-N'-(5-methyl-2-oxoindolin-3-ylidene)acetohydrazide is C17H15N7O4.
What is the molecular weight of (E)-2-(3-methyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)-N'-(5-methyl-2-oxoindolin-3-ylidene)acetohydrazide?
The molecular weight of (E)-2-(3-methyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)-N'-(5-methyl-2-oxoindolin-3-ylidene)acetohydrazide is 381.12 g/mol.
Where can I buy (E)-2-(3-methyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)-N'-(5-methyl-2-oxoindolin-3-ylidene)acetohydrazide?
You can request a quote for (E)-2-(3-methyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)-N'-(5-methyl-2-oxoindolin-3-ylidene)acetohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-2-(3-methyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)-N'-(5-methyl-2-oxoindolin-3-ylidene)acetohydrazide?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-(3-methyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)-N'-(5-methyl-2-oxoindolin-3-ylidene)acetohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.