m-Isobutyramidophenyl tert-butylcarbamate
TL;DR: m-Isobutyramidophenyl tert-butylcarbamate (CAS 17787-98-3) is a chemical compound with molecular formula C15H22N2O3 and molecular weight 278.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(2-methylpropanoylamino)phenyl] N-tert-butylcarbamate
Also Known As: m-Isobutyramidophenyl tert-butylcarbamate, starbld0014532, Propionanilide, tert-butylcarbamate, 3-Isobutyramidophenyl tert-butylcarbamate, [3-(2-methylpropanoylamino)phenyl] N-tert-butylcarbamate
| Molecular Formula | C15H22N2O3 |
|---|---|
| Molecular Weight | 278.16 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 67.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 278.16306 |
| Heavy Atoms | 20 |
| Complexity | 348.0 |
Chemical Identifiers
| CAS Number | 17787-98-3 |
|---|---|
| SMILES | CC(C)C(=O)NC1=CC(=CC=C1)OC(=O)NC(C)(C)C |
| InChIKey | GKYKHTPBXMEFKN-UHFFFAOYSA-N |
Product Overview
m-Isobutyramidophenyl tert-butylcarbamate (CAS 17787-98-3), with molecular formula C15H22N2O3 and molecular weight 278.16 g/mol. IUPAC: [3-(2-methylpropanoylamino)phenyl] N-tert-butylcarbamate.
Chemical Property Profile of m-Isobutyramidophenyl tert-butylcarbamate
Property Insights of m-Isobutyramidophenyl tert-butylcarbamate
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for m-Isobutyramidophenyl tert-butylcarbamate. The TPSA of 67.4 Ų falls within the moderate polarity range, balancing permeability and solubility for m-Isobutyramidophenyl tert-butylcarbamate. Following Lipinski's Rule of Five, m-Isobutyramidophenyl tert-butylcarbamate has 2 hydrogen bond donor(s) and 3 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 m-Isobutyramidophenyl tert-butylcarbamate?
The CAS number of m-Isobutyramidophenyl tert-butylcarbamate is 17787-98-3.
What is the molecular formula of m-Isobutyramidophenyl tert-butylcarbamate?
The molecular formula of m-Isobutyramidophenyl tert-butylcarbamate is C15H22N2O3.
What is the molecular weight of m-Isobutyramidophenyl tert-butylcarbamate?
The molecular weight of m-Isobutyramidophenyl tert-butylcarbamate is 278.16 g/mol.
Where can I buy m-Isobutyramidophenyl tert-butylcarbamate?
You can request a quote for m-Isobutyramidophenyl tert-butylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for m-Isobutyramidophenyl tert-butylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for m-Isobutyramidophenyl tert-butylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.