Ethyl (2-((2-chlorophenyl)amino)benzo[d][1,3]dioxol-2-yl)carbamate
TL;DR: Ethyl (2-((2-chlorophenyl)amino)benzo[d][1,3]dioxol-2-yl)carbamate (CAS 438015-44-2) is a chemical compound with molecular formula C16H15ClN2O4 and molecular weight 334.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-[2-(2-chloroanilino)-1,3-benzodioxol-2-yl]carbamate
Also Known As: ChemDiv3_006415, IDI1_024325, F1023-0177, ethyl (2-((2-chlorophenyl)amino)benzo[d][1,3]dioxol-2-yl)carbamate, ethyl N-[2-(2-chloroanilino)-1,3-benzodioxol-2-yl]carbamate
| Molecular Formula | C16H15ClN2O4 |
|---|---|
| Molecular Weight | 334.07 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 68.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 334.07202 |
| Heavy Atoms | 23 |
| Complexity | 409.0 |
Chemical Identifiers
| CAS Number | 438015-44-2 |
|---|---|
| SMILES | CCOC(=O)NC1(OC2=CC=CC=C2O1)NC3=CC=CC=C3Cl |
| InChIKey | UYEIZUXOHRDAQO-UHFFFAOYSA-N |
Product Overview
Ethyl (2-((2-chlorophenyl)amino)benzo[d][1,3]dioxol-2-yl)carbamate (CAS 438015-44-2), with molecular formula C16H15ClN2O4 and molecular weight 334.07 g/mol. IUPAC: ethyl N-[2-(2-chloroanilino)-1,3-benzodioxol-2-yl]carbamate.
Chemical Property Profile of Ethyl (2-((2-chlorophenyl)amino)benzo[d][1,3]dioxol-2-yl)carbamate
Property Insights of Ethyl (2-((2-chlorophenyl)amino)benzo[d][1,3]dioxol-2-yl)carbamate
The XLogP value of 4.8 indicates that Ethyl (2-((2-chlorophenyl)amino)benzo[d][1,3]dioxol-2-yl)carbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl (2-((2-chlorophenyl)amino)benzo[d][1,3]dioxol-2-yl)carbamate. Following Lipinski's Rule of Five, Ethyl (2-((2-chlorophenyl)amino)benzo[d][1,3]dioxol-2-yl)carbamate 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 Ethyl (2-((2-chlorophenyl)amino)benzo[d][1,3]dioxol-2-yl)carbamate?
The CAS number of Ethyl (2-((2-chlorophenyl)amino)benzo[d][1,3]dioxol-2-yl)carbamate is 438015-44-2.
What is the molecular formula of Ethyl (2-((2-chlorophenyl)amino)benzo[d][1,3]dioxol-2-yl)carbamate?
The molecular formula of Ethyl (2-((2-chlorophenyl)amino)benzo[d][1,3]dioxol-2-yl)carbamate is C16H15ClN2O4.
What is the molecular weight of Ethyl (2-((2-chlorophenyl)amino)benzo[d][1,3]dioxol-2-yl)carbamate?
The molecular weight of Ethyl (2-((2-chlorophenyl)amino)benzo[d][1,3]dioxol-2-yl)carbamate is 334.07 g/mol.
Where can I buy Ethyl (2-((2-chlorophenyl)amino)benzo[d][1,3]dioxol-2-yl)carbamate?
You can request a quote for Ethyl (2-((2-chlorophenyl)amino)benzo[d][1,3]dioxol-2-yl)carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl (2-((2-chlorophenyl)amino)benzo[d][1,3]dioxol-2-yl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl (2-((2-chlorophenyl)amino)benzo[d][1,3]dioxol-2-yl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.