![[3-(propanoylamino)phenyl] N,N-dimethylcarbamate structure](/static/products/1778/17788-33-9.webp)
[3-(propanoylamino)phenyl] N,N-dimethylcarbamate
TL;DR: [3-(propanoylamino)phenyl] N,N-dimethylcarbamate (CAS 17788-33-9) 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-(propanoylamino)phenyl] N,N-dimethylcarbamate
Also Known As: 3-Propanamidophenyl dimethylcarbamate, [3-(propanoylamino)phenyl] N,N-dimethylcarbamate
| Molecular Formula | C12H16N2O3 |
|---|---|
| Molecular Weight | 236.12 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 58.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 236.11609 |
| Heavy Atoms | 17 |
| Complexity | 279.0 |
Chemical Identifiers
| CAS Number | 17788-33-9 |
|---|---|
| SMILES | CCC(=O)NC1=CC(=CC=C1)OC(=O)N(C)C |
| InChIKey | QWNDYCWYSZWAKM-UHFFFAOYSA-N |
Product Overview
[3-(propanoylamino)phenyl] N,N-dimethylcarbamate (CAS 17788-33-9), with molecular formula C12H16N2O3 and molecular weight 236.12 g/mol. IUPAC: [3-(propanoylamino)phenyl] N,N-dimethylcarbamate.
Chemical Property Profile of [3-(propanoylamino)phenyl] N,N-dimethylcarbamate
Property Insights of [3-(propanoylamino)phenyl] N,N-dimethylcarbamate
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [3-(propanoylamino)phenyl] N,N-dimethylcarbamate. With a topological polar surface area (TPSA) of 58.6 Ų, [3-(propanoylamino)phenyl] N,N-dimethylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [3-(propanoylamino)phenyl] N,N-dimethylcarbamate has 1 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-(propanoylamino)phenyl] N,N-dimethylcarbamate?
The CAS number of [3-(propanoylamino)phenyl] N,N-dimethylcarbamate is 17788-33-9.
What is the molecular formula of [3-(propanoylamino)phenyl] N,N-dimethylcarbamate?
The molecular formula of [3-(propanoylamino)phenyl] N,N-dimethylcarbamate is C12H16N2O3.
What is the molecular weight of [3-(propanoylamino)phenyl] N,N-dimethylcarbamate?
The molecular weight of [3-(propanoylamino)phenyl] N,N-dimethylcarbamate is 236.12 g/mol.
Where can I buy [3-(propanoylamino)phenyl] N,N-dimethylcarbamate?
You can request a quote for [3-(propanoylamino)phenyl] N,N-dimethylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [3-(propanoylamino)phenyl] N,N-dimethylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for [3-(propanoylamino)phenyl] N,N-dimethylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.