N-(2-Methoxy-4-{[(4-methoxy-3-nitrobenzoyl)carbamothioyl]ami
TL;DR: N-(2-Methoxy-4-{[(4-methoxy-3-nitrobenzoyl)carbamothioyl]ami (CAS 593241-18-0) is a chemical compound with molecular formula C25H20N4O7S and molecular weight 520.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-methoxy-4-[(4-methoxy-3-nitrobenzoyl)carbamothioylamino]phenyl]-1-benzofuran-2-carboxamide
Also Known As: N-(2-Methoxy-4-{[(4-methoxy-3-nitrobenzoyl)carbamothioyl]ami, N-[2-methoxy-4-({[(4-methoxy-3-nitrobenzoyl)amino]carbonothioyl}amino)phenyl]-1-benzofuran-2-carboxamide, N-[2-methoxy-4-({[(4-methoxy-3-nitrophenyl)carbonyl]carbamothioyl}amino)phenyl]-1-benzofuran-2-carboxamide, N-[2-methoxy-4-[(4-methoxy-3-nitrobenzoyl)carbamothioylamino]phenyl]-1-benzofuran-2-carboxamide
| Molecular Formula | C25H20N4O7S |
|---|---|
| Molecular Weight | 520.11 g/mol |
| LogP | 4.7373 |
| Topological Polar Surface Area | 144.97 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 520.1053 |
| Heavy Atoms | 37 |
| Complexity | 1499.7611 |
Chemical Identifiers
| CAS Number | 593241-18-0 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)NC(=O)C3=CC4=CC=CC=C4O3)OC)[N+](=O)[O-] |
Product Overview
N-(2-Methoxy-4-{[(4-methoxy-3-nitrobenzoyl)carbamothioyl]ami (CAS 593241-18-0), with molecular formula C25H20N4O7S and molecular weight 520.11 g/mol. IUPAC: N-[2-methoxy-4-[(4-methoxy-3-nitrobenzoyl)carbamothioylamino]phenyl]-1-benzofuran-2-carboxamide.
Chemical Property Profile of N-(2-Methoxy-4-{[(4-methoxy-3-nitrobenzoyl)carbamothioyl]ami
Property Insights of N-(2-Methoxy-4-{[(4-methoxy-3-nitrobenzoyl)carbamothioyl]ami
The XLogP value of 4.7373 indicates that N-(2-Methoxy-4-{[(4-methoxy-3-nitrobenzoyl)carbamothioyl]ami is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 144.97 Ų indicates high polarity, suggesting N-(2-Methoxy-4-{[(4-methoxy-3-nitrobenzoyl)carbamothioyl]ami may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-(2-Methoxy-4-{[(4-methoxy-3-nitrobenzoyl)carbamothioyl]ami has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(2-Methoxy-4-{[(4-methoxy-3-nitrobenzoyl)carbamothioyl]ami?
The CAS number of N-(2-Methoxy-4-{[(4-methoxy-3-nitrobenzoyl)carbamothioyl]ami is 593241-18-0.
What is the molecular formula of N-(2-Methoxy-4-{[(4-methoxy-3-nitrobenzoyl)carbamothioyl]ami?
The molecular formula of N-(2-Methoxy-4-{[(4-methoxy-3-nitrobenzoyl)carbamothioyl]ami is C25H20N4O7S.
What is the molecular weight of N-(2-Methoxy-4-{[(4-methoxy-3-nitrobenzoyl)carbamothioyl]ami?
The molecular weight of N-(2-Methoxy-4-{[(4-methoxy-3-nitrobenzoyl)carbamothioyl]ami is 520.11 g/mol.
Where can I buy N-(2-Methoxy-4-{[(4-methoxy-3-nitrobenzoyl)carbamothioyl]ami?
You can request a quote for N-(2-Methoxy-4-{[(4-methoxy-3-nitrobenzoyl)carbamothioyl]ami 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-{[(4-methoxy-3-nitrobenzoyl)carbamothioyl]ami?
Yes, KEHONG BIO provides custom synthesis services for N-(2-Methoxy-4-{[(4-methoxy-3-nitrobenzoyl)carbamothioyl]ami and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.