![[(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 1-ethyl-1H-1,2,3-benzotriazole-5-carboxylate structure](/static/products/121/1211780-79-8.png)
[(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 1-ethyl-1H-1,2,3-benzotriazole-5-carboxylate
TL;DR: [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 1-ethyl-1H-1,2,3-benzotriazole-5-carboxylate (CAS 1211780-79-8) is a chemical compound with molecular formula C19H23N5O3 and molecular weight 369.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] 1-ethylbenzotriazole-5-carboxylate
Also Known As: [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 1-ethyl-1H-1,2,3-benzotriazole-5-carboxylate|[2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] 1-ethylbenzotriazole-5-carboxylate|EN300-23512115
| Molecular Formula | C19H23N5O3 |
|---|---|
| Molecular Weight | 369.18 g/mol |
| LogP | 2.29288 |
| Topological Polar Surface Area | 101.11 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 369.18008 |
| Heavy Atoms | 27 |
| Complexity | 892.37244 |
Chemical Identifiers
| CAS Number | 1211780-79-8 |
|---|---|
| SMILES | CCN1C2=C(C=C(C=C2)C(=O)OCC(=O)N(C)C3(CCCCC3)C#N)N=N1 |
Product Overview
[(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 1-ethyl-1H-1,2,3-benzotriazole-5-carboxylate (CAS 1211780-79-8), with molecular formula C19H23N5O3 and molecular weight 369.18 g/mol. IUPAC: [2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] 1-ethylbenzotriazole-5-carboxylate.
Chemical Property Profile of [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 1-ethyl-1H-1,2,3-benzotriazole-5-carboxylate
Property Insights of [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 1-ethyl-1H-1,2,3-benzotriazole-5-carboxylate
The XLogP value of 2.29288 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 1-ethyl-1H-1,2,3-benzotriazole-5-carboxylate. The TPSA of 101.11 Ų falls within the moderate polarity range, balancing permeability and solubility for [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 1-ethyl-1H-1,2,3-benzotriazole-5-carboxylate. Following Lipinski's Rule of Five, [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 1-ethyl-1H-1,2,3-benzotriazole-5-carboxylate 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 [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 1-ethyl-1H-1,2,3-benzotriazole-5-carboxylate?
The CAS number of [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 1-ethyl-1H-1,2,3-benzotriazole-5-carboxylate is 1211780-79-8.
What is the molecular formula of [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 1-ethyl-1H-1,2,3-benzotriazole-5-carboxylate?
The molecular formula of [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 1-ethyl-1H-1,2,3-benzotriazole-5-carboxylate is C19H23N5O3.
What is the molecular weight of [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 1-ethyl-1H-1,2,3-benzotriazole-5-carboxylate?
The molecular weight of [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 1-ethyl-1H-1,2,3-benzotriazole-5-carboxylate is 369.18 g/mol.
Where can I buy [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 1-ethyl-1H-1,2,3-benzotriazole-5-carboxylate?
You can request a quote for [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 1-ethyl-1H-1,2,3-benzotriazole-5-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)(methyl)carbamoyl]methyl 1-ethyl-1H-1,2,3-benzotriazole-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 1-ethyl-1H-1,2,3-benzotriazole-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.