Thiourea, N-(2-benzoyl-4-nitrophenyl)-N'-(4-ethoxyphenyl)-
TL;DR: Thiourea, N-(2-benzoyl-4-nitrophenyl)-N'-(4-ethoxyphenyl)- (CAS 111044-14-5) is a chemical compound with molecular formula C22H19N3O4S and molecular weight 421.10962 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2-benzoyl-4-nitrophenyl)-3-(4-ethoxyphenyl)thiourea
Also Known As: N-(2-Benzoyl-4-nitrophenyl)-N'-(4-ethoxyphenyl)thiourea, Thiourea, N-(2-benzoyl-4-nitrophenyl)-N'-(4-ethoxyphenyl)-, 1-(2-benzoyl-4-nitrophenyl)-3-(4-ethoxyphenyl)thiourea
Technical Specifications
| Molecular Formula | C22H19N3O4S |
| Molecular Weight | 421.10962 g/mol |
| XLogP | 5.1 |
| Topological Polar Surface Area (TPSA) | 128.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 421.10962 Da |
| Heavy Atoms | 30 |
| Complexity | 598.0 |
| SMILES | CCOC1=CC=C(C=C1)NC(=S)NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=CC=C3 |
| InChIKey | XXCNXNPSGSKBOD-UHFFFAOYSA-N |
Chemical Property Profile of Thiourea, N-(2-benzoyl-4-nitrophenyl)-N'-(4-ethoxyphenyl)-
Property Insights of Thiourea, N-(2-benzoyl-4-nitrophenyl)-N'-(4-ethoxyphenyl)-
The XLogP value of 5.1 indicates that Thiourea, N-(2-benzoyl-4-nitrophenyl)-N'-(4-ethoxyphenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 128.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Thiourea, N-(2-benzoyl-4-nitrophenyl)-N'-(4-ethoxyphenyl)-. Following Lipinski's Rule of Five, Thiourea, N-(2-benzoyl-4-nitrophenyl)-N'-(4-ethoxyphenyl)- has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Thiourea, N-(2-benzoyl-4-nitrophenyl)-N'-(4-ethoxyphenyl)-?
The CAS number of Thiourea, N-(2-benzoyl-4-nitrophenyl)-N'-(4-ethoxyphenyl)- is 111044-14-5.
What is the molecular formula of Thiourea, N-(2-benzoyl-4-nitrophenyl)-N'-(4-ethoxyphenyl)-?
The molecular formula of Thiourea, N-(2-benzoyl-4-nitrophenyl)-N'-(4-ethoxyphenyl)- is C22H19N3O4S.
What is the molecular weight of Thiourea, N-(2-benzoyl-4-nitrophenyl)-N'-(4-ethoxyphenyl)-?
The molecular weight of Thiourea, N-(2-benzoyl-4-nitrophenyl)-N'-(4-ethoxyphenyl)- is 421.10962 g/mol.
Where can I buy Thiourea, N-(2-benzoyl-4-nitrophenyl)-N'-(4-ethoxyphenyl)-?
You can request a quote for Thiourea, N-(2-benzoyl-4-nitrophenyl)-N'-(4-ethoxyphenyl)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Thiourea, N-(2-benzoyl-4-nitrophenyl)-N'-(4-ethoxyphenyl)-?
Yes, CoreyChem provides custom synthesis services for Thiourea, N-(2-benzoyl-4-nitrophenyl)-N'-(4-ethoxyphenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.