2-(Acetylamino)naphthalene-1,4-diyl diacetate
TL;DR: 2-(Acetylamino)naphthalene-1,4-diyl diacetate (CAS 6961-27-9) is a chemical compound with molecular formula C16H15NO5 and molecular weight 301.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-acetamido-4-acetyloxynaphthalen-1-yl) acetate
Also Known As: 2-(acetylamino)naphthalene-1,4-diyl diacetate, 1,4-Diacetoxy-2-acetylamino-naphthalin, (3-acetamido-4-acetyloxynaphthalen-1-yl) acetate, 2-Acetamidonaphthalene-1,4-diyl diacetate
| Molecular Formula | C16H15NO5 |
|---|---|
| Molecular Weight | 301.10 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 81.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 301.09503 |
| Heavy Atoms | 22 |
| Complexity | 450.0 |
Chemical Identifiers
| CAS Number | 6961-27-9 |
|---|---|
| SMILES | CC(=O)NC1=C(C2=CC=CC=C2C(=C1)OC(=O)C)OC(=O)C |
| InChIKey | PTXJPKFIQMFSAA-UHFFFAOYSA-N |
Product Overview
2-(Acetylamino)naphthalene-1,4-diyl diacetate (CAS 6961-27-9), with molecular formula C16H15NO5 and molecular weight 301.10 g/mol. IUPAC: (3-acetamido-4-acetyloxynaphthalen-1-yl) acetate.
Chemical Property Profile of 2-(Acetylamino)naphthalene-1,4-diyl diacetate
Property Insights of 2-(Acetylamino)naphthalene-1,4-diyl diacetate
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Acetylamino)naphthalene-1,4-diyl diacetate. The TPSA of 81.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Acetylamino)naphthalene-1,4-diyl diacetate. Following Lipinski's Rule of Five, 2-(Acetylamino)naphthalene-1,4-diyl diacetate has 1 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 2-(Acetylamino)naphthalene-1,4-diyl diacetate?
The CAS number of 2-(Acetylamino)naphthalene-1,4-diyl diacetate is 6961-27-9.
What is the molecular formula of 2-(Acetylamino)naphthalene-1,4-diyl diacetate?
The molecular formula of 2-(Acetylamino)naphthalene-1,4-diyl diacetate is C16H15NO5.
What is the molecular weight of 2-(Acetylamino)naphthalene-1,4-diyl diacetate?
The molecular weight of 2-(Acetylamino)naphthalene-1,4-diyl diacetate is 301.10 g/mol.
Where can I buy 2-(Acetylamino)naphthalene-1,4-diyl diacetate?
You can request a quote for 2-(Acetylamino)naphthalene-1,4-diyl diacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Acetylamino)naphthalene-1,4-diyl diacetate?
Yes, KEHONG BIO provides custom synthesis services for 2-(Acetylamino)naphthalene-1,4-diyl diacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.