3'-羟基丁酰苯胺甲基氨基甲酸酯
TL;DR: 3'-羟基丁酰苯胺甲基氨基甲酸酯 (CAS 17814-27-6) is a chemical compound with molecular formula C12H16N2O3 and molecular weight 236.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3'-羟基丁酰苯胺甲基氨基甲酸酯
[3-(butanoylamino)phenyl] N-methylcarbamate
Also Known As: Stauffer R 12466, m-Butyramidophenyl methylcarbamate, 3'-(Methylcarbamoyloxy)butyranilide, Butyranilide, methylcarbamate, [3-(butanoylamino)phenyl] N-methylcarbamate
| Molecular Formula | C12H16N2O3 |
|---|---|
| Molecular Weight | 236.12 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 67.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 236.11609 |
| Heavy Atoms | 17 |
| Complexity | 268.0 |
Chemical Identifiers
| CAS Number | 17814-27-6 |
|---|---|
| SMILES | CCCC(=O)NC1=CC(=CC=C1)OC(=O)NC |
| InChIKey | GHLKYRZGJLDUAG-UHFFFAOYSA-N |
Product Overview
3'-羟基丁酰苯胺甲基氨基甲酸酯 (CAS 17814-27-6), with molecular formula C12H16N2O3 and molecular weight 236.12 g/mol. IUPAC: [3-(butanoylamino)phenyl] N-methylcarbamate.
Chemical Property Profile of 3'-羟基丁酰苯胺甲基氨基甲酸酯
Property Insights of 3'-羟基丁酰苯胺甲基氨基甲酸酯
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3'-羟基丁酰苯胺甲基氨基甲酸酯. The TPSA of 67.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3'-羟基丁酰苯胺甲基氨基甲酸酯. Following Lipinski's Rule of Five, 3'-羟基丁酰苯胺甲基氨基甲酸酯 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 3'-羟基丁酰苯胺甲基氨基甲酸酯?
The CAS number of 3'-羟基丁酰苯胺甲基氨基甲酸酯 is 17814-27-6.
What is the molecular formula of 3'-羟基丁酰苯胺甲基氨基甲酸酯?
The molecular formula of 3'-羟基丁酰苯胺甲基氨基甲酸酯 is C12H16N2O3.
What is the molecular weight of 3'-羟基丁酰苯胺甲基氨基甲酸酯?
The molecular weight of 3'-羟基丁酰苯胺甲基氨基甲酸酯 is 236.12 g/mol.
Where can I buy 3'-羟基丁酰苯胺甲基氨基甲酸酯?
You can request a quote for 3'-羟基丁酰苯胺甲基氨基甲酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3'-羟基丁酰苯胺甲基氨基甲酸酯?
Yes, KEHONG BIO provides custom synthesis services for 3'-羟基丁酰苯胺甲基氨基甲酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.