Carbanilide, 2-hydroxy-5-nitrothio-
TL;DR: Carbanilide, 2-hydroxy-5-nitrothio- (CAS 13528-21-7) is a chemical compound with molecular formula C13H11N3O3S and molecular weight 289.05212 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2-hydroxy-5-nitrophenyl)-3-phenylthiourea
Also Known As: PTU 25, 2-Hydroxy-5-nitrothio-carbanilide, 2-hydroxy-5-nitrothiocarbanilide, 1-(2-hydroxy-5-nitrophenyl)-3-phenylthiourea, CARBANILIDE, 2-HYDROXY-5-NITROTHIO-
Technical Specifications
| Molecular Formula | C13H11N3O3S |
| Molecular Weight | 289.05212 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 122.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 289.05212 Da |
| Heavy Atoms | 20 |
| Complexity | 355.0 |
| SMILES | C1=CC=C(C=C1)NC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])O |
| InChIKey | ZKFLJXAZHSLWDS-UHFFFAOYSA-N |
Chemical Property Profile of Carbanilide, 2-hydroxy-5-nitrothio-
Property Insights of Carbanilide, 2-hydroxy-5-nitrothio-
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbanilide, 2-hydroxy-5-nitrothio-. The TPSA of 122.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbanilide, 2-hydroxy-5-nitrothio-. Following Lipinski's Rule of Five, Carbanilide, 2-hydroxy-5-nitrothio- has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Carbanilide, 2-hydroxy-5-nitrothio-?
The CAS number of Carbanilide, 2-hydroxy-5-nitrothio- is 13528-21-7.
What is the molecular formula of Carbanilide, 2-hydroxy-5-nitrothio-?
The molecular formula of Carbanilide, 2-hydroxy-5-nitrothio- is C13H11N3O3S.
What is the molecular weight of Carbanilide, 2-hydroxy-5-nitrothio-?
The molecular weight of Carbanilide, 2-hydroxy-5-nitrothio- is 289.05212 g/mol.
Where can I buy Carbanilide, 2-hydroxy-5-nitrothio-?
You can request a quote for Carbanilide, 2-hydroxy-5-nitrothio- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Carbanilide, 2-hydroxy-5-nitrothio-?
Yes, CoreyChem provides custom synthesis services for Carbanilide, 2-hydroxy-5-nitrothio- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.