![[2-[(2-chlorophenyl)methylamino]-2-oxoethyl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate structure](/static/products/4778/477806-28-3.webp)
[2-[(2-chlorophenyl)methylamino]-2-oxoethyl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate
TL;DR: [2-[(2-chlorophenyl)methylamino]-2-oxoethyl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate (CAS 477806-28-3) is a chemical compound with molecular formula C18H16ClNO5 and molecular weight 361.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(2-chlorophenyl)methylamino]-2-oxoethyl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate
Also Known As: [2-[(2-chlorophenyl)methylamino]-2-oxoethyl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate, 2-{[(2-Chlorophenyl)methyl]amino}-2-oxoethyl 2,3-dihydro-1,4-benzodioxine-6-carboxylate
| Molecular Formula | C18H16ClNO5 |
|---|---|
| Molecular Weight | 361.07 g/mol |
| LogP | 2.5844 |
| Topological Polar Surface Area | 73.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 361.0717 |
| Heavy Atoms | 25 |
| Complexity | 792.78595 |
Chemical Identifiers
| CAS Number | 477806-28-3 |
|---|---|
| SMILES | C1COC2=C(O1)C=CC(=C2)C(=O)OCC(=O)NCC3=CC=CC=C3Cl |
Product Overview
[2-[(2-chlorophenyl)methylamino]-2-oxoethyl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate (CAS 477806-28-3), with molecular formula C18H16ClNO5 and molecular weight 361.07 g/mol. IUPAC: [2-[(2-chlorophenyl)methylamino]-2-oxoethyl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate.
Chemical Property Profile of [2-[(2-chlorophenyl)methylamino]-2-oxoethyl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate
Property Insights of [2-[(2-chlorophenyl)methylamino]-2-oxoethyl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate
The XLogP value of 2.5844 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [2-[(2-chlorophenyl)methylamino]-2-oxoethyl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate. The TPSA of 73.86 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-[(2-chlorophenyl)methylamino]-2-oxoethyl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate. Following Lipinski's Rule of Five, [2-[(2-chlorophenyl)methylamino]-2-oxoethyl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate has 1 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 [2-[(2-chlorophenyl)methylamino]-2-oxoethyl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate?
The CAS number of [2-[(2-chlorophenyl)methylamino]-2-oxoethyl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate is 477806-28-3.
What is the molecular formula of [2-[(2-chlorophenyl)methylamino]-2-oxoethyl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate?
The molecular formula of [2-[(2-chlorophenyl)methylamino]-2-oxoethyl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate is C18H16ClNO5.
What is the molecular weight of [2-[(2-chlorophenyl)methylamino]-2-oxoethyl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate?
The molecular weight of [2-[(2-chlorophenyl)methylamino]-2-oxoethyl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate is 361.07 g/mol.
Where can I buy [2-[(2-chlorophenyl)methylamino]-2-oxoethyl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate?
You can request a quote for [2-[(2-chlorophenyl)methylamino]-2-oxoethyl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-[(2-chlorophenyl)methylamino]-2-oxoethyl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for [2-[(2-chlorophenyl)methylamino]-2-oxoethyl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.