tert-butyl N-[2-(2,5-dimethoxyanilino)-2-oxoethyl]carbamate
TL;DR: tert-butyl N-[2-(2,5-dimethoxyanilino)-2-oxoethyl]carbamate (CAS 1021998-84-4) is a chemical compound with molecular formula C15H22N2O5 and molecular weight 310.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl N-[2-(2,5-dimethoxyanilino)-2-oxoethyl]carbamate
Also Known As: N-(tert-butoxycarbonyl)-N1-(2,5-dimethoxyphenyl)glycinamide, tert-butyl N-[2-(2,5-dimethoxyanilino)-2-oxoethyl]carbamate, tert-butyl N-{[(2,5-dimethoxyphenyl)carbamoyl]methyl}carbamate, carbamic acid, [2-[(2,5-dimethoxyphenyl)amino]-2-oxoethyl]-, 1,1-dimethylethyl ester, Tert-butyl N-[(2,5-dimethoxyphenyl)carbamoylmethyl]carbamate
| Molecular Formula | C15H22N2O5 |
|---|---|
| Molecular Weight | 310.15 g/mol |
| LogP | 2.167 |
| Topological Polar Surface Area | 85.89 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 310.15286 |
| Heavy Atoms | 22 |
| Complexity | 537.2246 |
Chemical Identifiers
| CAS Number | 1021998-84-4 |
|---|---|
| SMILES | CC(C)(C)OC(=O)NCC(=O)NC1=C(C=CC(=C1)OC)OC |
Product Overview
tert-butyl N-[2-(2,5-dimethoxyanilino)-2-oxoethyl]carbamate (CAS 1021998-84-4), with molecular formula C15H22N2O5 and molecular weight 310.15 g/mol. IUPAC: tert-butyl N-[2-(2,5-dimethoxyanilino)-2-oxoethyl]carbamate.
Chemical Property Profile of tert-butyl N-[2-(2,5-dimethoxyanilino)-2-oxoethyl]carbamate
Property Insights of tert-butyl N-[2-(2,5-dimethoxyanilino)-2-oxoethyl]carbamate
The XLogP value of 2.167 suggests moderate lipophilicity, balancing water solubility and membrane permeability for tert-butyl N-[2-(2,5-dimethoxyanilino)-2-oxoethyl]carbamate. The TPSA of 85.89 Ų falls within the moderate polarity range, balancing permeability and solubility for tert-butyl N-[2-(2,5-dimethoxyanilino)-2-oxoethyl]carbamate. Following Lipinski's Rule of Five, tert-butyl N-[2-(2,5-dimethoxyanilino)-2-oxoethyl]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 tert-butyl N-[2-(2,5-dimethoxyanilino)-2-oxoethyl]carbamate?
The CAS number of tert-butyl N-[2-(2,5-dimethoxyanilino)-2-oxoethyl]carbamate is 1021998-84-4.
What is the molecular formula of tert-butyl N-[2-(2,5-dimethoxyanilino)-2-oxoethyl]carbamate?
The molecular formula of tert-butyl N-[2-(2,5-dimethoxyanilino)-2-oxoethyl]carbamate is C15H22N2O5.
What is the molecular weight of tert-butyl N-[2-(2,5-dimethoxyanilino)-2-oxoethyl]carbamate?
The molecular weight of tert-butyl N-[2-(2,5-dimethoxyanilino)-2-oxoethyl]carbamate is 310.15 g/mol.
Where can I buy tert-butyl N-[2-(2,5-dimethoxyanilino)-2-oxoethyl]carbamate?
You can request a quote for tert-butyl N-[2-(2,5-dimethoxyanilino)-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-(2,5-dimethoxyanilino)-2-oxoethyl]carbamate?
Yes, KEHONG BIO provides custom synthesis services for tert-butyl N-[2-(2,5-dimethoxyanilino)-2-oxoethyl]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.