N,N'-dimethyl-N,N'-dinitrosoterephthalamide
TL;DR: N,N'-dimethyl-N,N'-dinitrosoterephthalamide (CAS 133-55-1) is a chemical compound with molecular formula C10H10N4O4 and molecular weight 250.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-N,4-N-dimethyl-1-N,4-N-dinitrosobenzene-1,4-dicarboxamide
Also Known As: Nitrosan, N,N'-Dimethyl-N,N'-dinitrosoterephthalamide, N,N'-Dimethylterephthalamide, BL 353, N,N'-dinitrosoterephthalamide
| Molecular Formula | C10H10N4O4 |
|---|---|
| Molecular Weight | 250.07 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 99.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 250.0702 |
| Heavy Atoms | 18 |
| Complexity | 318.0 |
Chemical Identifiers
| CAS Number | 133-55-1 |
|---|---|
| SMILES | CN(C(=O)C1=CC=C(C=C1)C(=O)N(C)N=O)N=O |
| InChIKey | CQSQUYVFNGIECQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N,N'-dimethyl-N,N'-dinitrosoterephthalamide (CAS 133-55-1), with molecular formula C10H10N4O4 and molecular weight 250.07 g/mol. IUPAC: 1-N,4-N-dimethyl-1-N,4-N-dinitrosobenzene-1,4-dicarboxamide.
Chemical Property Profile of N,N'-dimethyl-N,N'-dinitrosoterephthalamide
Property Insights of N,N'-dimethyl-N,N'-dinitrosoterephthalamide
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N'-dimethyl-N,N'-dinitrosoterephthalamide. The TPSA of 99.5 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N'-dimethyl-N,N'-dinitrosoterephthalamide. Following Lipinski's Rule of Five, N,N'-dimethyl-N,N'-dinitrosoterephthalamide has 0 hydrogen bond donor(s) and 6 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,N'-dimethyl-N,N'-dinitrosoterephthalamide?
The CAS number of N,N'-dimethyl-N,N'-dinitrosoterephthalamide is 133-55-1.
What is the molecular formula of N,N'-dimethyl-N,N'-dinitrosoterephthalamide?
The molecular formula of N,N'-dimethyl-N,N'-dinitrosoterephthalamide is C10H10N4O4.
What is the molecular weight of N,N'-dimethyl-N,N'-dinitrosoterephthalamide?
The molecular weight of N,N'-dimethyl-N,N'-dinitrosoterephthalamide is 250.07 g/mol.
Where can I buy N,N'-dimethyl-N,N'-dinitrosoterephthalamide?
You can request a quote for N,N'-dimethyl-N,N'-dinitrosoterephthalamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N'-dimethyl-N,N'-dinitrosoterephthalamide?
Yes, KEHONG BIO provides custom synthesis services for N,N'-dimethyl-N,N'-dinitrosoterephthalamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.