N-(1,4-dioxonaphthalen-2-yl)propanamide
TL;DR: N-(1,4-dioxonaphthalen-2-yl)propanamide (CAS 65938-98-9) is a chemical compound with molecular formula C13H11NO3 and molecular weight 229.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,4-dioxonaphthalen-2-yl)propanamide
Also Known As: N-(1,4-dioxonaphthalen-2-yl)propanamide, 2-(Propionylamino)-1,4-naphthoquinone, n-(1,4-dioxo-1,4-dihydronaphthalen-2-yl)propanamide, N-(1,4-Dioxonaphthalene-2-yl)propionamide, N-(1,4-dioxo-1,4-dihydronaphthalen-2-yl)propionamide
| Molecular Formula | C13H11NO3 |
|---|---|
| Molecular Weight | 229.07 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 63.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 229.0739 |
| Heavy Atoms | 17 |
| Complexity | 397.0 |
Chemical Identifiers
| CAS Number | 65938-98-9 |
|---|---|
| SMILES | CCC(=O)NC1=CC(=O)C2=CC=CC=C2C1=O |
| InChIKey | YPZZDADIYRZQDH-UHFFFAOYSA-N |
Product Overview
N-(1,4-dioxonaphthalen-2-yl)propanamide (CAS 65938-98-9), with molecular formula C13H11NO3 and molecular weight 229.07 g/mol. IUPAC: N-(1,4-dioxonaphthalen-2-yl)propanamide.
Chemical Property Profile of N-(1,4-dioxonaphthalen-2-yl)propanamide
Property Insights of N-(1,4-dioxonaphthalen-2-yl)propanamide
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1,4-dioxonaphthalen-2-yl)propanamide. The TPSA of 63.2 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,4-dioxonaphthalen-2-yl)propanamide. Following Lipinski's Rule of Five, N-(1,4-dioxonaphthalen-2-yl)propanamide 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 N-(1,4-dioxonaphthalen-2-yl)propanamide?
The CAS number of N-(1,4-dioxonaphthalen-2-yl)propanamide is 65938-98-9.
What is the molecular formula of N-(1,4-dioxonaphthalen-2-yl)propanamide?
The molecular formula of N-(1,4-dioxonaphthalen-2-yl)propanamide is C13H11NO3.
What is the molecular weight of N-(1,4-dioxonaphthalen-2-yl)propanamide?
The molecular weight of N-(1,4-dioxonaphthalen-2-yl)propanamide is 229.07 g/mol.
Where can I buy N-(1,4-dioxonaphthalen-2-yl)propanamide?
You can request a quote for N-(1,4-dioxonaphthalen-2-yl)propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1,4-dioxonaphthalen-2-yl)propanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,4-dioxonaphthalen-2-yl)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.