N-(3-chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-N-methylglycine
TL;DR: N-(3-chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-N-methylglycine (CAS 903585-92-2) is a chemical compound with molecular formula C13H10ClNO4 and molecular weight 279.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3-chloro-1,4-dioxonaphthalen-2-yl)-methylamino]acetic acid
Also Known As: 2-[(3-chloro-1,4-dioxo-naphthalen-2-yl)-methyl-amino]acetic Acid, 2-[(3-chloro-1,4-dioxonaphthalen-2-yl)-methylamino]acetic acid, N-(3-chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-N-methylglycine, 2-((3-chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)(methyl)amino)acetic acid
| Molecular Formula | C13H10ClNO4 |
|---|---|
| Molecular Weight | 279.03 g/mol |
| LogP | 1.5324 |
| Topological Polar Surface Area | 74.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 279.02985 |
| Heavy Atoms | 19 |
| Complexity | 620.82416 |
Chemical Identifiers
| CAS Number | 903585-92-2 |
|---|---|
| SMILES | CN(CC(=O)O)C1=C(C(=O)C2=CC=CC=C2C1=O)Cl |
Product Overview
N-(3-chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-N-methylglycine (CAS 903585-92-2), with molecular formula C13H10ClNO4 and molecular weight 279.03 g/mol. IUPAC: 2-[(3-chloro-1,4-dioxonaphthalen-2-yl)-methylamino]acetic acid.
Chemical Property Profile of N-(3-chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-N-methylglycine
Property Insights of N-(3-chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-N-methylglycine
The XLogP value of 1.5324 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-N-methylglycine. The TPSA of 74.68 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-N-methylglycine. Following Lipinski's Rule of Five, N-(3-chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-N-methylglycine 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 N-(3-chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-N-methylglycine?
The CAS number of N-(3-chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-N-methylglycine is 903585-92-2.
What is the molecular formula of N-(3-chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-N-methylglycine?
The molecular formula of N-(3-chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-N-methylglycine is C13H10ClNO4.
What is the molecular weight of N-(3-chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-N-methylglycine?
The molecular weight of N-(3-chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-N-methylglycine is 279.03 g/mol.
Where can I buy N-(3-chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-N-methylglycine?
You can request a quote for N-(3-chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-N-methylglycine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-N-methylglycine?
Yes, KEHONG BIO provides custom synthesis services for N-(3-chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-N-methylglycine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.