![[2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] 2-(1,3-dioxoisoindol-2-yl)acetate structure](/static/products/100/1004735-85-6.png)
[2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] 2-(1,3-dioxoisoindol-2-yl)acetate
TL;DR: [2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] 2-(1,3-dioxoisoindol-2-yl)acetate (CAS 1004735-85-6) is a chemical compound with molecular formula C20H21N3O5 and molecular weight 383.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] 2-(1,3-dioxoisoindol-2-yl)acetate
Also Known As: [2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] 2-(1,3-dioxoisoindol-2-yl)acetate|[(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)acetate|EN300-26680684
| Molecular Formula | C20H21N3O5 |
|---|---|
| Molecular Weight | 383.15 g/mol |
| LogP | 1.51068 |
| Topological Polar Surface Area | 107.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 383.14813 |
| Heavy Atoms | 28 |
| Complexity | 831.8373 |
Chemical Identifiers
| CAS Number | 1004735-85-6 |
|---|---|
| SMILES | CN(C(=O)COC(=O)CN1C(=O)C2=CC=CC=C2C1=O)C3(CCCCC3)C#N |
Product Overview
[2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] 2-(1,3-dioxoisoindol-2-yl)acetate (CAS 1004735-85-6), with molecular formula C20H21N3O5 and molecular weight 383.15 g/mol. IUPAC: [2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] 2-(1,3-dioxoisoindol-2-yl)acetate.
Chemical Property Profile of [2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] 2-(1,3-dioxoisoindol-2-yl)acetate
Property Insights of [2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] 2-(1,3-dioxoisoindol-2-yl)acetate
The XLogP value of 1.51068 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] 2-(1,3-dioxoisoindol-2-yl)acetate. The TPSA of 107.78 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] 2-(1,3-dioxoisoindol-2-yl)acetate. Following Lipinski's Rule of Five, [2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] 2-(1,3-dioxoisoindol-2-yl)acetate has 0 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 [2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] 2-(1,3-dioxoisoindol-2-yl)acetate?
The CAS number of [2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] 2-(1,3-dioxoisoindol-2-yl)acetate is 1004735-85-6.
What is the molecular formula of [2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] 2-(1,3-dioxoisoindol-2-yl)acetate?
The molecular formula of [2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] 2-(1,3-dioxoisoindol-2-yl)acetate is C20H21N3O5.
What is the molecular weight of [2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] 2-(1,3-dioxoisoindol-2-yl)acetate?
The molecular weight of [2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] 2-(1,3-dioxoisoindol-2-yl)acetate is 383.15 g/mol.
Where can I buy [2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] 2-(1,3-dioxoisoindol-2-yl)acetate?
You can request a quote for [2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] 2-(1,3-dioxoisoindol-2-yl)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] 2-(1,3-dioxoisoindol-2-yl)acetate?
Yes, KEHONG BIO provides custom synthesis services for [2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] 2-(1,3-dioxoisoindol-2-yl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.