![[(1-cyanocyclohexyl)carbamoyl]methyl 2-(1H-indol-3-yl)acetate structure](/static/products/100/1003199-86-7.png)
[(1-cyanocyclohexyl)carbamoyl]methyl 2-(1H-indol-3-yl)acetate
TL;DR: [(1-cyanocyclohexyl)carbamoyl]methyl 2-(1H-indol-3-yl)acetate (CAS 1003199-86-7) is a chemical compound with molecular formula C19H21N3O3 and molecular weight 339.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(1-cyanocyclohexyl)amino]-2-oxoethyl] 2-(1H-indol-3-yl)acetate
Also Known As: [(1-cyanocyclohexyl)carbamoyl]methyl 2-(1H-indol-3-yl)acetate|[2-[(1-cyanocyclohexyl)amino]-2-oxoethyl] 2-(1H-indol-3-yl)acetate|MLS002181559|SMR001270589|EN300-26687321
| Molecular Formula | C19H21N3O3 |
|---|---|
| Molecular Weight | 339.16 g/mol |
| LogP | 2.59628 |
| Topological Polar Surface Area | 94.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 339.1583 |
| Heavy Atoms | 25 |
| Complexity | 812.6738 |
Chemical Identifiers
| CAS Number | 1003199-86-7 |
|---|---|
| SMILES | C1CCC(CC1)(C#N)NC(=O)COC(=O)CC2=CNC3=CC=CC=C32 |
Product Overview
[(1-cyanocyclohexyl)carbamoyl]methyl 2-(1H-indol-3-yl)acetate (CAS 1003199-86-7), with molecular formula C19H21N3O3 and molecular weight 339.16 g/mol. IUPAC: [2-[(1-cyanocyclohexyl)amino]-2-oxoethyl] 2-(1H-indol-3-yl)acetate.
Chemical Property Profile of [(1-cyanocyclohexyl)carbamoyl]methyl 2-(1H-indol-3-yl)acetate
Property Insights of [(1-cyanocyclohexyl)carbamoyl]methyl 2-(1H-indol-3-yl)acetate
The XLogP value of 2.59628 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(1-cyanocyclohexyl)carbamoyl]methyl 2-(1H-indol-3-yl)acetate. The TPSA of 94.98 Ų falls within the moderate polarity range, balancing permeability and solubility for [(1-cyanocyclohexyl)carbamoyl]methyl 2-(1H-indol-3-yl)acetate. Following Lipinski's Rule of Five, [(1-cyanocyclohexyl)carbamoyl]methyl 2-(1H-indol-3-yl)acetate has 2 hydrogen bond donor(s) and 4 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 [(1-cyanocyclohexyl)carbamoyl]methyl 2-(1H-indol-3-yl)acetate?
The CAS number of [(1-cyanocyclohexyl)carbamoyl]methyl 2-(1H-indol-3-yl)acetate is 1003199-86-7.
What is the molecular formula of [(1-cyanocyclohexyl)carbamoyl]methyl 2-(1H-indol-3-yl)acetate?
The molecular formula of [(1-cyanocyclohexyl)carbamoyl]methyl 2-(1H-indol-3-yl)acetate is C19H21N3O3.
What is the molecular weight of [(1-cyanocyclohexyl)carbamoyl]methyl 2-(1H-indol-3-yl)acetate?
The molecular weight of [(1-cyanocyclohexyl)carbamoyl]methyl 2-(1H-indol-3-yl)acetate is 339.16 g/mol.
Where can I buy [(1-cyanocyclohexyl)carbamoyl]methyl 2-(1H-indol-3-yl)acetate?
You can request a quote for [(1-cyanocyclohexyl)carbamoyl]methyl 2-(1H-indol-3-yl)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(1-cyanocyclohexyl)carbamoyl]methyl 2-(1H-indol-3-yl)acetate?
Yes, KEHONG BIO provides custom synthesis services for [(1-cyanocyclohexyl)carbamoyl]methyl 2-(1H-indol-3-yl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.