Benzamide, N-methyl-2-nitro-N-(2-(((phenylamino)thioxomethyl)amino)cyclopentyl)-
TL;DR: Benzamide, N-methyl-2-nitro-N-(2-(((phenylamino)thioxomethyl)amino)cyclopentyl)- (CAS 77051-80-0) is a chemical compound with molecular formula C20H22N4O3S and molecular weight 398.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-methyl-2-nitro-N-[2-(phenylcarbamothioylamino)cyclopentyl]benzamide
Also Known As: N-Methyl-2-nitro-N-(2-(((phenylamino)thioxomethyl)amino)cyclopentyl)benzamide, BENZAMIDE, N-METHYL-2-NITRO-N-(2-(((PHENYLAMINO)THIOXOMETHYL)AMINO)CYCLOPENTYL)-, N-methyl-2-nitro-N-[2-(phenylcarbamothioylamino)cyclopentyl]benzamide, N-[2-(N-Methyl-2-nitrobenzamido)cyclopentyl]-N'-phenylcarbamimidothioic acid, N-{2-[Methyl(2-nitrobenzoyl)amino]cyclopentyl}-N'-phenylcarbamimidothioic acid
| Molecular Formula | C20H22N4O3S |
|---|---|
| Molecular Weight | 398.14 g/mol |
| LogP | 3.5745 |
| Topological Polar Surface Area | 87.51 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 398.14127 |
| Heavy Atoms | 28 |
| Complexity | 874.76434 |
Chemical Identifiers
| CAS Number | 77051-80-0 |
|---|---|
| SMILES | CN(C1CCCC1NC(=S)NC2=CC=CC=C2)C(=O)C3=CC=CC=C3[N+](=O)[O-] |
Product Overview
Benzamide, N-methyl-2-nitro-N-(2-(((phenylamino)thioxomethyl)amino)cyclopentyl)- (CAS 77051-80-0), with molecular formula C20H22N4O3S and molecular weight 398.14 g/mol. IUPAC: N-methyl-2-nitro-N-[2-(phenylcarbamothioylamino)cyclopentyl]benzamide.
Chemical Property Profile of Benzamide, N-methyl-2-nitro-N-(2-(((phenylamino)thioxomethyl)amino)cyclopentyl)-
Property Insights of Benzamide, N-methyl-2-nitro-N-(2-(((phenylamino)thioxomethyl)amino)cyclopentyl)-
The XLogP value of 3.5745 indicates that Benzamide, N-methyl-2-nitro-N-(2-(((phenylamino)thioxomethyl)amino)cyclopentyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.51 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzamide, N-methyl-2-nitro-N-(2-(((phenylamino)thioxomethyl)amino)cyclopentyl)-. Following Lipinski's Rule of Five, Benzamide, N-methyl-2-nitro-N-(2-(((phenylamino)thioxomethyl)amino)cyclopentyl)- 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 Benzamide, N-methyl-2-nitro-N-(2-(((phenylamino)thioxomethyl)amino)cyclopentyl)-?
The CAS number of Benzamide, N-methyl-2-nitro-N-(2-(((phenylamino)thioxomethyl)amino)cyclopentyl)- is 77051-80-0.
What is the molecular formula of Benzamide, N-methyl-2-nitro-N-(2-(((phenylamino)thioxomethyl)amino)cyclopentyl)-?
The molecular formula of Benzamide, N-methyl-2-nitro-N-(2-(((phenylamino)thioxomethyl)amino)cyclopentyl)- is C20H22N4O3S.
What is the molecular weight of Benzamide, N-methyl-2-nitro-N-(2-(((phenylamino)thioxomethyl)amino)cyclopentyl)-?
The molecular weight of Benzamide, N-methyl-2-nitro-N-(2-(((phenylamino)thioxomethyl)amino)cyclopentyl)- is 398.14 g/mol.
Where can I buy Benzamide, N-methyl-2-nitro-N-(2-(((phenylamino)thioxomethyl)amino)cyclopentyl)-?
You can request a quote for Benzamide, N-methyl-2-nitro-N-(2-(((phenylamino)thioxomethyl)amino)cyclopentyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzamide, N-methyl-2-nitro-N-(2-(((phenylamino)thioxomethyl)amino)cyclopentyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzamide, N-methyl-2-nitro-N-(2-(((phenylamino)thioxomethyl)amino)cyclopentyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.