![[(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 1-ethyl-1H-1,2,3-benzotriazole-5-carboxylate structure](/static/products/121/1211780-79-8.webp)
[(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 369.18008 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[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|Z17495783
Technical Specifications
| Molecular Formula | C19H23N5O3 |
| Molecular Weight | 369.18008 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 101.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 369.18008 Da |
| Heavy Atoms | 27 |
| Complexity | 610.0 |
| SMILES | CCN1C2=C(C=C(C=C2)C(=O)OCC(=O)N(C)C3(CCCCC3)C#N)N=N1 |
| InChIKey | PVSNWMWDEUNDFA-UHFFFAOYSA-N |
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 2.2 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 101.0 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
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 369.18008 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 CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 1-ethyl-1H-1,2,3-benzotriazole-5-carboxylate?
Yes, CoreyChem 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.