![[N,N-dimethyl-N'-(N-methyl-2,4-dinitroanilino)carbamimidoyl] benzoate structure](/static/products/7242/7242-20-8.webp)
[N,N-dimethyl-N'-(N-methyl-2,4-dinitroanilino)carbamimidoyl] benzoate
TL;DR: [N,N-dimethyl-N'-(N-methyl-2,4-dinitroanilino)carbamimidoyl] benzoate (CAS 7242-20-8) is a chemical compound with molecular formula C17H17N5O6 and molecular weight 387.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[N,N-dimethyl-N'-(N-methyl-2,4-dinitroanilino)carbamimidoyl] benzoate
Also Known As: [N,N-dimethyl-N'-(N-methyl-2,4-dinitroanilino)carbamimidoyl] benzoate|Benzoyl N'-(2,4-dinitrophenyl)-N,N,N'-trimethylcarbamohydrazonate|[N'-[(2,4-dinitrophenyl)-methyl-amino]-N,N-dimethyl-carbamimidoyl] Benzoate
| Molecular Formula | C17H17N5O6 |
|---|---|
| Molecular Weight | 387.12 g/mol |
| LogP | 2.6288 |
| Topological Polar Surface Area | 131.42 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 387.1179 |
| Heavy Atoms | 28 |
| Complexity | 928.89014 |
Chemical Identifiers
| CAS Number | 7242-20-8 |
|---|---|
| SMILES | CN(C)C(=NN(C)C1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])OC(=O)C2=CC=CC=C2 |
Product Overview
[N,N-dimethyl-N'-(N-methyl-2,4-dinitroanilino)carbamimidoyl] benzoate (CAS 7242-20-8), with molecular formula C17H17N5O6 and molecular weight 387.12 g/mol. IUPAC: [N,N-dimethyl-N'-(N-methyl-2,4-dinitroanilino)carbamimidoyl] benzoate.
Chemical Property Profile of [N,N-dimethyl-N'-(N-methyl-2,4-dinitroanilino)carbamimidoyl] benzoate
Property Insights of [N,N-dimethyl-N'-(N-methyl-2,4-dinitroanilino)carbamimidoyl] benzoate
The XLogP value of 2.6288 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [N,N-dimethyl-N'-(N-methyl-2,4-dinitroanilino)carbamimidoyl] benzoate. The TPSA of 131.42 Ų falls within the moderate polarity range, balancing permeability and solubility for [N,N-dimethyl-N'-(N-methyl-2,4-dinitroanilino)carbamimidoyl] benzoate. Following Lipinski's Rule of Five, [N,N-dimethyl-N'-(N-methyl-2,4-dinitroanilino)carbamimidoyl] benzoate has 0 hydrogen bond donor(s) and 8 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-methyl-2,4-dinitroanilino)carbamimidoyl] benzoate?
The CAS number of [N,N-dimethyl-N'-(N-methyl-2,4-dinitroanilino)carbamimidoyl] benzoate is 7242-20-8.
What is the molecular formula of [N,N-dimethyl-N'-(N-methyl-2,4-dinitroanilino)carbamimidoyl] benzoate?
The molecular formula of [N,N-dimethyl-N'-(N-methyl-2,4-dinitroanilino)carbamimidoyl] benzoate is C17H17N5O6.
What is the molecular weight of [N,N-dimethyl-N'-(N-methyl-2,4-dinitroanilino)carbamimidoyl] benzoate?
The molecular weight of [N,N-dimethyl-N'-(N-methyl-2,4-dinitroanilino)carbamimidoyl] benzoate is 387.12 g/mol.
Where can I buy [N,N-dimethyl-N'-(N-methyl-2,4-dinitroanilino)carbamimidoyl] benzoate?
You can request a quote for [N,N-dimethyl-N'-(N-methyl-2,4-dinitroanilino)carbamimidoyl] benzoate 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-methyl-2,4-dinitroanilino)carbamimidoyl] benzoate?
Yes, KEHONG BIO provides custom synthesis services for [N,N-dimethyl-N'-(N-methyl-2,4-dinitroanilino)carbamimidoyl] benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.