N-acetyl-2,3-diaminonaphthoquinone
TL;DR: N-acetyl-2,3-diaminonaphthoquinone (CAS 13755-96-9) is a chemical compound with molecular formula C12H10N2O3 and molecular weight 230.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-amino-1,4-dioxonaphthalen-2-yl)acetamide
Also Known As: N-acetyl-2,3-diaminonaphthoquinone, 2-Acetylamino-3-amino-1,4-naphthoquinone, 2-acetamido-3-amino-1,4-naphthoquinone, NCI60_017573, N-(3-amino-1,4-dioxonaphthalen-2-yl)acetamide
| Molecular Formula | C12H10N2O3 |
|---|---|
| Molecular Weight | 230.07 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 89.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 230.06914 |
| Heavy Atoms | 17 |
| Complexity | 425.0 |
Chemical Identifiers
| CAS Number | 13755-96-9 |
|---|---|
| SMILES | CC(=O)NC1=C(C(=O)C2=CC=CC=C2C1=O)N |
| InChIKey | IZJNNHJVNPVRHJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-acetyl-2,3-diaminonaphthoquinone (CAS 13755-96-9), with molecular formula C12H10N2O3 and molecular weight 230.07 g/mol. IUPAC: N-(3-amino-1,4-dioxonaphthalen-2-yl)acetamide.
Chemical Property Profile of N-acetyl-2,3-diaminonaphthoquinone
Property Insights of N-acetyl-2,3-diaminonaphthoquinone
The XLogP value of -0.5 indicates that N-acetyl-2,3-diaminonaphthoquinone is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 89.3 Ų falls within the moderate polarity range, balancing permeability and solubility for N-acetyl-2,3-diaminonaphthoquinone. Following Lipinski's Rule of Five, N-acetyl-2,3-diaminonaphthoquinone has 2 hydrogen bond donor(s) and 4 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-acetyl-2,3-diaminonaphthoquinone?
The CAS number of N-acetyl-2,3-diaminonaphthoquinone is 13755-96-9.
What is the molecular formula of N-acetyl-2,3-diaminonaphthoquinone?
The molecular formula of N-acetyl-2,3-diaminonaphthoquinone is C12H10N2O3.
What is the molecular weight of N-acetyl-2,3-diaminonaphthoquinone?
The molecular weight of N-acetyl-2,3-diaminonaphthoquinone is 230.07 g/mol.
Where can I buy N-acetyl-2,3-diaminonaphthoquinone?
You can request a quote for N-acetyl-2,3-diaminonaphthoquinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-acetyl-2,3-diaminonaphthoquinone?
Yes, KEHONG BIO provides custom synthesis services for N-acetyl-2,3-diaminonaphthoquinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.