5-(N-carbobenzyloxyamino)-1,4-naphthoquinone
TL;DR: 5-(N-carbobenzyloxyamino)-1,4-naphthoquinone (CAS 129112-30-7) is a chemical compound with molecular formula C18H13NO4 and molecular weight 307.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl N-(5,8-dioxonaphthalen-1-yl)carbamate
Also Known As: 5-Cbon, 5-(N-Carbobenzyloxyamino)-1,4-naphthoquinone, benzyl N-(5,8-dioxonaphthalen-1-yl)carbamate, 5-(Benzyloxycarbonylamino)-1,4-naphthoquinone, Phenylmethyl (5,8-dihydro-5,8-dioxo-1-naphthalenyl)carbamate
| Molecular Formula | C18H13NO4 |
|---|---|
| Molecular Weight | 307.08 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 72.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 307.08447 |
| Heavy Atoms | 23 |
| Complexity | 507.0 |
Chemical Identifiers
| CAS Number | 129112-30-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC(=O)NC2=CC=CC3=C2C(=O)C=CC3=O |
| InChIKey | HWUUKAGLKUIYFY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-(N-carbobenzyloxyamino)-1,4-naphthoquinone (CAS 129112-30-7), with molecular formula C18H13NO4 and molecular weight 307.08 g/mol. IUPAC: benzyl N-(5,8-dioxonaphthalen-1-yl)carbamate.
Chemical Property Profile of 5-(N-carbobenzyloxyamino)-1,4-naphthoquinone
Property Insights of 5-(N-carbobenzyloxyamino)-1,4-naphthoquinone
The XLogP value of 3.1 indicates that 5-(N-carbobenzyloxyamino)-1,4-naphthoquinone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(N-carbobenzyloxyamino)-1,4-naphthoquinone. Following Lipinski's Rule of Five, 5-(N-carbobenzyloxyamino)-1,4-naphthoquinone has 1 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 5-(N-carbobenzyloxyamino)-1,4-naphthoquinone?
The CAS number of 5-(N-carbobenzyloxyamino)-1,4-naphthoquinone is 129112-30-7.
What is the molecular formula of 5-(N-carbobenzyloxyamino)-1,4-naphthoquinone?
The molecular formula of 5-(N-carbobenzyloxyamino)-1,4-naphthoquinone is C18H13NO4.
What is the molecular weight of 5-(N-carbobenzyloxyamino)-1,4-naphthoquinone?
The molecular weight of 5-(N-carbobenzyloxyamino)-1,4-naphthoquinone is 307.08 g/mol.
Where can I buy 5-(N-carbobenzyloxyamino)-1,4-naphthoquinone?
You can request a quote for 5-(N-carbobenzyloxyamino)-1,4-naphthoquinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(N-carbobenzyloxyamino)-1,4-naphthoquinone?
Yes, KEHONG BIO provides custom synthesis services for 5-(N-carbobenzyloxyamino)-1,4-naphthoquinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.