![N-[(2-methoxy-4-nitrophenyl)carbamothioyl]-3,4-dimethylbenzamide structure](/static/products/3352/335213-38-2.webp)
N-[(2-methoxy-4-nitrophenyl)carbamothioyl]-3,4-dimethylbenzamide
TL;DR: N-[(2-methoxy-4-nitrophenyl)carbamothioyl]-3,4-dimethylbenzamide (CAS 335213-38-2) is a chemical compound with molecular formula C17H17N3O4S and molecular weight 359.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2-methoxy-4-nitrophenyl)carbamothioyl]-3,4-dimethylbenzamide
Also Known As: BAS 02818557, N-[(2-methoxy-4-nitrophenyl)carbamothioyl]-3,4-dimethylbenzamide, N-(3,4-dimethylbenzoyl)-N'-{4-nitro-2-methoxyphenyl}thiourea, 1-(3,4-Dimethyl-benzoyl)-3-(2-methoxy-4-nitro-phenyl)-thiourea, (3,4-dimethylphenyl)-N-{[(2-methoxy-4-nitrophenyl)amino]thioxomethyl}carboxami de
| Molecular Formula | C17H17N3O4S |
|---|---|
| Molecular Weight | 359.09 g/mol |
| LogP | 3.34704 |
| Topological Polar Surface Area | 93.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 359.09396 |
| Heavy Atoms | 25 |
| Complexity | 851.78174 |
Chemical Identifiers
| CAS Number | 335213-38-2 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)NC(=S)NC2=C(C=C(C=C2)[N+](=O)[O-])OC)C |
Product Overview
N-[(2-methoxy-4-nitrophenyl)carbamothioyl]-3,4-dimethylbenzamide (CAS 335213-38-2), with molecular formula C17H17N3O4S and molecular weight 359.09 g/mol. IUPAC: N-[(2-methoxy-4-nitrophenyl)carbamothioyl]-3,4-dimethylbenzamide.
Chemical Property Profile of N-[(2-methoxy-4-nitrophenyl)carbamothioyl]-3,4-dimethylbenzamide
Property Insights of N-[(2-methoxy-4-nitrophenyl)carbamothioyl]-3,4-dimethylbenzamide
The XLogP value of 3.34704 indicates that N-[(2-methoxy-4-nitrophenyl)carbamothioyl]-3,4-dimethylbenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.5 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(2-methoxy-4-nitrophenyl)carbamothioyl]-3,4-dimethylbenzamide. Following Lipinski's Rule of Five, N-[(2-methoxy-4-nitrophenyl)carbamothioyl]-3,4-dimethylbenzamide has 2 hydrogen bond donor(s) and 5 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-[(2-methoxy-4-nitrophenyl)carbamothioyl]-3,4-dimethylbenzamide?
The CAS number of N-[(2-methoxy-4-nitrophenyl)carbamothioyl]-3,4-dimethylbenzamide is 335213-38-2.
What is the molecular formula of N-[(2-methoxy-4-nitrophenyl)carbamothioyl]-3,4-dimethylbenzamide?
The molecular formula of N-[(2-methoxy-4-nitrophenyl)carbamothioyl]-3,4-dimethylbenzamide is C17H17N3O4S.
What is the molecular weight of N-[(2-methoxy-4-nitrophenyl)carbamothioyl]-3,4-dimethylbenzamide?
The molecular weight of N-[(2-methoxy-4-nitrophenyl)carbamothioyl]-3,4-dimethylbenzamide is 359.09 g/mol.
Where can I buy N-[(2-methoxy-4-nitrophenyl)carbamothioyl]-3,4-dimethylbenzamide?
You can request a quote for N-[(2-methoxy-4-nitrophenyl)carbamothioyl]-3,4-dimethylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(2-methoxy-4-nitrophenyl)carbamothioyl]-3,4-dimethylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(2-methoxy-4-nitrophenyl)carbamothioyl]-3,4-dimethylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.