tert-butyl N-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]carbamate
TL;DR: tert-butyl N-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]carbamate (CAS 1024396-69-7) is a chemical compound with molecular formula C14H19ClN2O4 and molecular weight 314.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl N-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]carbamate
Also Known As: tert-butyl N-{[(5-chloro-2-methoxyphenyl)carbamoyl]methyl}carbamate, tert-butyl N-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]carbamate, N-(tert-butoxycarbonyl)-N1-(5-chloro-2-methoxyphenyl)glycinamide, carbamic acid, [2-[(5-chloro-2-methoxyphenyl)amino]-2-oxoethyl]-, 1,1-dimethylethyl ester, Tert-butyl N-[(5-chloro-2-methoxy-phenyl)carbamoylmethyl]carbamate
| Molecular Formula | C14H19ClN2O4 |
|---|---|
| Molecular Weight | 314.10 g/mol |
| LogP | 2.8118 |
| Topological Polar Surface Area | 76.66 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 314.10333 |
| Heavy Atoms | 21 |
| Complexity | 526.19556 |
Chemical Identifiers
| CAS Number | 1024396-69-7 |
|---|---|
| SMILES | CC(C)(C)OC(=O)NCC(=O)NC1=C(C=CC(=C1)Cl)OC |
Product Overview
tert-butyl N-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]carbamate (CAS 1024396-69-7), with molecular formula C14H19ClN2O4 and molecular weight 314.10 g/mol. IUPAC: tert-butyl N-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]carbamate.
Chemical Property Profile of tert-butyl N-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]carbamate
Property Insights of tert-butyl N-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]carbamate
The XLogP value of 2.8118 suggests moderate lipophilicity, balancing water solubility and membrane permeability for tert-butyl N-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]carbamate. The TPSA of 76.66 Ų falls within the moderate polarity range, balancing permeability and solubility for tert-butyl N-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]carbamate. Following Lipinski's Rule of Five, tert-butyl N-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]carbamate has 2 hydrogen bond donor(s) and 4 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 tert-butyl N-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]carbamate?
The CAS number of tert-butyl N-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]carbamate is 1024396-69-7.
What is the molecular formula of tert-butyl N-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]carbamate?
The molecular formula of tert-butyl N-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]carbamate is C14H19ClN2O4.
What is the molecular weight of tert-butyl N-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]carbamate?
The molecular weight of tert-butyl N-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]carbamate is 314.10 g/mol.
Where can I buy tert-butyl N-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]carbamate?
You can request a quote for tert-butyl N-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for tert-butyl N-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]carbamate?
Yes, KEHONG BIO provides custom synthesis services for tert-butyl N-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.