![N'-[2-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-3-methylsulfanylpropanoyl]adamantane-1-carbohydrazide structure](/static/products/1024/1024594-87-3.webp)
N'-[2-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-3-methylsulfanylpropanoyl]adamantane-1-carbohydrazide
TL;DR: N'-[2-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-3-methylsulfanylpropanoyl]adamantane-1-carbohydrazide (CAS 1024594-87-3) is a chemical compound with molecular formula C23H33N3O4S and molecular weight 447.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-[2-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-3-methylsulfanylpropanoyl]adamantane-1-carbohydrazide
Also Known As: N'-[2-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-3-methylsulfanylpropanoyl]adamantane-1-carbohydrazide, Octahydro-alpha-[(methylthio)methyl]-1,3-dioxo-2H-isoindole-2-acetic acid 2-(tricyclo[3.3.1.13,7]dec-1-ylcarbonyl)hydrazide, Octahydro-I+/--[(methylthio)methyl]-1,3-dioxo-2H-isoindole-2-acetic acid 2-(tricyclo[3.3.1.13,7]dec-1-ylcarbonyl)hydrazide
| Molecular Formula | C23H33N3O4S |
|---|---|
| Molecular Weight | 447.22 g/mol |
| LogP | 2.257 |
| Topological Polar Surface Area | 95.58 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 447.21918 |
| Heavy Atoms | 31 |
| Complexity | 740.40686 |
Chemical Identifiers
| CAS Number | 1024594-87-3 |
|---|---|
| SMILES | CSCC(C(=O)NNC(=O)C12CC3CC(C1)CC(C3)C2)N4C(=O)C5CCCCC5C4=O |
Product Overview
N'-[2-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-3-methylsulfanylpropanoyl]adamantane-1-carbohydrazide (CAS 1024594-87-3), with molecular formula C23H33N3O4S and molecular weight 447.22 g/mol. IUPAC: N'-[2-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-3-methylsulfanylpropanoyl]adamantane-1-carbohydrazide.
Chemical Property Profile of N'-[2-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-3-methylsulfanylpropanoyl]adamantane-1-carbohydrazide
Property Insights of N'-[2-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-3-methylsulfanylpropanoyl]adamantane-1-carbohydrazide
The XLogP value of 2.257 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N'-[2-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-3-methylsulfanylpropanoyl]adamantane-1-carbohydrazide. The TPSA of 95.58 Ų falls within the moderate polarity range, balancing permeability and solubility for N'-[2-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-3-methylsulfanylpropanoyl]adamantane-1-carbohydrazide. Following Lipinski's Rule of Five, N'-[2-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-3-methylsulfanylpropanoyl]adamantane-1-carbohydrazide has 2 hydrogen bond donor(s) and 5 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 N'-[2-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-3-methylsulfanylpropanoyl]adamantane-1-carbohydrazide?
The CAS number of N'-[2-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-3-methylsulfanylpropanoyl]adamantane-1-carbohydrazide is 1024594-87-3.
What is the molecular formula of N'-[2-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-3-methylsulfanylpropanoyl]adamantane-1-carbohydrazide?
The molecular formula of N'-[2-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-3-methylsulfanylpropanoyl]adamantane-1-carbohydrazide is C23H33N3O4S.
What is the molecular weight of N'-[2-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-3-methylsulfanylpropanoyl]adamantane-1-carbohydrazide?
The molecular weight of N'-[2-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-3-methylsulfanylpropanoyl]adamantane-1-carbohydrazide is 447.22 g/mol.
Where can I buy N'-[2-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-3-methylsulfanylpropanoyl]adamantane-1-carbohydrazide?
You can request a quote for N'-[2-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-3-methylsulfanylpropanoyl]adamantane-1-carbohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N'-[2-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-3-methylsulfanylpropanoyl]adamantane-1-carbohydrazide?
Yes, KEHONG BIO provides custom synthesis services for N'-[2-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-3-methylsulfanylpropanoyl]adamantane-1-carbohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.