Cyclohexylcarbamoylcarbamoylmethyl 3-methyl-2-phenyl-quinoline-4-carboxylate
TL;DR: Cyclohexylcarbamoylcarbamoylmethyl 3-methyl-2-phenyl-quinoline-4-carboxylate (CAS 5478-28-4) is a chemical compound with molecular formula C26H27N3O4 and molecular weight 445.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(cyclohexylcarbamoylamino)-2-oxoethyl] 3-methyl-2-phenylquinoline-4-carboxylate
Also Known As: Cyclohexylcarbamoylcarbamoylmethyl 3-methyl-2-phenyl-quinoline-4-carboxylate, 2-(3-Cyclohexylureido)-2-oxoethyl 3-methyl-2-phenylquinoline-4-carboxylate, [2-(cyclohexylcarbamoylamino)-2-oxoethyl] 3-methyl-2-phenylquinoline-4-carboxylate, 2-[(CYCLOHEXYLCARBAMOYL)AMINO]-2-OXOETHYL 3-METHYL-2-PHENYLQUINOLINE-4-CARBOXYLATE
| Molecular Formula | C26H27N3O4 |
|---|---|
| Molecular Weight | 445.20 g/mol |
| LogP | 4.52552 |
| Topological Polar Surface Area | 97.39 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 445.20016 |
| Heavy Atoms | 33 |
| Complexity | 1170.8755 |
Chemical Identifiers
| CAS Number | 5478-28-4 |
|---|---|
| SMILES | CC1=C(C2=CC=CC=C2N=C1C3=CC=CC=C3)C(=O)OCC(=O)NC(=O)NC4CCCCC4 |
Product Overview
Cyclohexylcarbamoylcarbamoylmethyl 3-methyl-2-phenyl-quinoline-4-carboxylate (CAS 5478-28-4), with molecular formula C26H27N3O4 and molecular weight 445.20 g/mol. IUPAC: [2-(cyclohexylcarbamoylamino)-2-oxoethyl] 3-methyl-2-phenylquinoline-4-carboxylate.
Chemical Property Profile of Cyclohexylcarbamoylcarbamoylmethyl 3-methyl-2-phenyl-quinoline-4-carboxylate
Property Insights of Cyclohexylcarbamoylcarbamoylmethyl 3-methyl-2-phenyl-quinoline-4-carboxylate
The XLogP value of 4.52552 indicates that Cyclohexylcarbamoylcarbamoylmethyl 3-methyl-2-phenyl-quinoline-4-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.39 Ų falls within the moderate polarity range, balancing permeability and solubility for Cyclohexylcarbamoylcarbamoylmethyl 3-methyl-2-phenyl-quinoline-4-carboxylate. Following Lipinski's Rule of Five, Cyclohexylcarbamoylcarbamoylmethyl 3-methyl-2-phenyl-quinoline-4-carboxylate has 2 hydrogen bond donor(s) and 5 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 Cyclohexylcarbamoylcarbamoylmethyl 3-methyl-2-phenyl-quinoline-4-carboxylate?
The CAS number of Cyclohexylcarbamoylcarbamoylmethyl 3-methyl-2-phenyl-quinoline-4-carboxylate is 5478-28-4.
What is the molecular formula of Cyclohexylcarbamoylcarbamoylmethyl 3-methyl-2-phenyl-quinoline-4-carboxylate?
The molecular formula of Cyclohexylcarbamoylcarbamoylmethyl 3-methyl-2-phenyl-quinoline-4-carboxylate is C26H27N3O4.
What is the molecular weight of Cyclohexylcarbamoylcarbamoylmethyl 3-methyl-2-phenyl-quinoline-4-carboxylate?
The molecular weight of Cyclohexylcarbamoylcarbamoylmethyl 3-methyl-2-phenyl-quinoline-4-carboxylate is 445.20 g/mol.
Where can I buy Cyclohexylcarbamoylcarbamoylmethyl 3-methyl-2-phenyl-quinoline-4-carboxylate?
You can request a quote for Cyclohexylcarbamoylcarbamoylmethyl 3-methyl-2-phenyl-quinoline-4-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclohexylcarbamoylcarbamoylmethyl 3-methyl-2-phenyl-quinoline-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Cyclohexylcarbamoylcarbamoylmethyl 3-methyl-2-phenyl-quinoline-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.