![[(1-cyanocyclohexyl)carbamoyl]methyl 2-oxo-2H-chromene-3-carboxylate structure](/static/products/100/1003514-67-7.png)
[(1-cyanocyclohexyl)carbamoyl]methyl 2-oxo-2H-chromene-3-carboxylate
TL;DR: [(1-cyanocyclohexyl)carbamoyl]methyl 2-oxo-2H-chromene-3-carboxylate (CAS 1003514-67-7) is a chemical compound with molecular formula C19H18N2O5 and molecular weight 354.12 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-oxochromene-3-carboxylate
Also Known As: AB00992293-01, [(1-cyanocyclohexyl)carbamoyl]methyl 2-oxo-2H-chromene-3-carboxylate, [2-[(1-cyanocyclohexyl)amino]-2-oxoethyl] 2-oxochromene-3-carboxylate
| Molecular Formula | C19H18N2O5 |
|---|---|
| Molecular Weight | 354.12 g/mol |
| LogP | 2.29248 |
| Topological Polar Surface Area | 109.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 354.12158 |
| Heavy Atoms | 26 |
| Complexity | 934.8304 |
Chemical Identifiers
| CAS Number | 1003514-67-7 |
|---|---|
| SMILES | C1CCC(CC1)(C#N)NC(=O)COC(=O)C2=CC3=CC=CC=C3OC2=O |
Product Overview
[(1-cyanocyclohexyl)carbamoyl]methyl 2-oxo-2H-chromene-3-carboxylate (CAS 1003514-67-7), with molecular formula C19H18N2O5 and molecular weight 354.12 g/mol. IUPAC: [2-[(1-cyanocyclohexyl)amino]-2-oxoethyl] 2-oxochromene-3-carboxylate.
Chemical Property Profile of [(1-cyanocyclohexyl)carbamoyl]methyl 2-oxo-2H-chromene-3-carboxylate
Property Insights of [(1-cyanocyclohexyl)carbamoyl]methyl 2-oxo-2H-chromene-3-carboxylate
The XLogP value of 2.29248 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(1-cyanocyclohexyl)carbamoyl]methyl 2-oxo-2H-chromene-3-carboxylate. The TPSA of 109.4 Ų falls within the moderate polarity range, balancing permeability and solubility for [(1-cyanocyclohexyl)carbamoyl]methyl 2-oxo-2H-chromene-3-carboxylate. Following Lipinski's Rule of Five, [(1-cyanocyclohexyl)carbamoyl]methyl 2-oxo-2H-chromene-3-carboxylate has 1 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 [(1-cyanocyclohexyl)carbamoyl]methyl 2-oxo-2H-chromene-3-carboxylate?
The CAS number of [(1-cyanocyclohexyl)carbamoyl]methyl 2-oxo-2H-chromene-3-carboxylate is 1003514-67-7.
What is the molecular formula of [(1-cyanocyclohexyl)carbamoyl]methyl 2-oxo-2H-chromene-3-carboxylate?
The molecular formula of [(1-cyanocyclohexyl)carbamoyl]methyl 2-oxo-2H-chromene-3-carboxylate is C19H18N2O5.
What is the molecular weight of [(1-cyanocyclohexyl)carbamoyl]methyl 2-oxo-2H-chromene-3-carboxylate?
The molecular weight of [(1-cyanocyclohexyl)carbamoyl]methyl 2-oxo-2H-chromene-3-carboxylate is 354.12 g/mol.
Where can I buy [(1-cyanocyclohexyl)carbamoyl]methyl 2-oxo-2H-chromene-3-carboxylate?
You can request a quote for [(1-cyanocyclohexyl)carbamoyl]methyl 2-oxo-2H-chromene-3-carboxylate 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-oxo-2H-chromene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for [(1-cyanocyclohexyl)carbamoyl]methyl 2-oxo-2H-chromene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.