![1-[4-(4-Nitro-phenyl)-3-oxo-2-phenyl-[1,2,4]thiadiazolidin-(5Z)-ylidene]-3-phenyl-urea structure](/static/products/137/137577-17-4.webp)
1-[4-(4-Nitro-phenyl)-3-oxo-2-phenyl-[1,2,4]thiadiazolidin-(5Z)-ylidene]-3-phenyl-urea
TL;DR: 1-[4-(4-Nitro-phenyl)-3-oxo-2-phenyl-[1,2,4]thiadiazolidin-(5Z)-ylidene]-3-phenyl-urea (CAS 137577-17-4) is a chemical compound with molecular formula C21H15N5O4S and molecular weight 433.08447 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1Z)-1-[4-(4-nitrophenyl)-3-oxo-2-phenyl-1,2,4-thiadiazolidin-5-ylidene]-3-phenylurea
Also Known As: 1-[4-(4-Nitro-phenyl)-3-oxo-2-phenyl-[1,2,4]thiadiazolidin-(5Z)-ylidene]-3-phenyl-urea, 3-[4-(4-nitrophenyl)-3-oxo-2-phenyl-1,2,4-thiadiazolidin-5-ylidene]-1-phenylurea, 4-(4-Nitrophenyl)-2-phenyl-5-[(phenylcarbamoyl)imino]-1,2,4-thiadiazolidin-3-one, 4-(p-Nitrophenyl)-2-phenyl-5-phenylcarbamoylimino-1,2,4-thiadiazolidin-3-one
Technical Specifications
| Molecular Formula | C21H15N5O4S |
| Molecular Weight | 433.08447 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 136.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 433.08447 Da |
| Heavy Atoms | 31 |
| Complexity | 707.0 |
| SMILES | C1=CC=C(C=C1)NC(=O)/N=C\2/N(C(=O)N(S2)C3=CC=CC=C3)C4=CC=C(C=C4)[N+](=O)[O-] |
| InChIKey | BNOLMNFZJUVGFA-ATJXCDBQSA-N |
Chemical Property Profile of 1-[4-(4-Nitro-phenyl)-3-oxo-2-phenyl-[1,2,4]thiadiazolidin-(5Z)-ylidene]-3-phenyl-urea
Property Insights of 1-[4-(4-Nitro-phenyl)-3-oxo-2-phenyl-[1,2,4]thiadiazolidin-(5Z)-ylidene]-3-phenyl-urea
The XLogP value of 4.4 indicates that 1-[4-(4-Nitro-phenyl)-3-oxo-2-phenyl-[1,2,4]thiadiazolidin-(5Z)-ylidene]-3-phenyl-urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 136.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[4-(4-Nitro-phenyl)-3-oxo-2-phenyl-[1,2,4]thiadiazolidin-(5Z)-ylidene]-3-phenyl-urea. Following Lipinski's Rule of Five, 1-[4-(4-Nitro-phenyl)-3-oxo-2-phenyl-[1,2,4]thiadiazolidin-(5Z)-ylidene]-3-phenyl-urea has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-[4-(4-Nitro-phenyl)-3-oxo-2-phenyl-[1,2,4]thiadiazolidin-(5Z)-ylidene]-3-phenyl-urea?
The CAS number of 1-[4-(4-Nitro-phenyl)-3-oxo-2-phenyl-[1,2,4]thiadiazolidin-(5Z)-ylidene]-3-phenyl-urea is 137577-17-4.
What is the molecular formula of 1-[4-(4-Nitro-phenyl)-3-oxo-2-phenyl-[1,2,4]thiadiazolidin-(5Z)-ylidene]-3-phenyl-urea?
The molecular formula of 1-[4-(4-Nitro-phenyl)-3-oxo-2-phenyl-[1,2,4]thiadiazolidin-(5Z)-ylidene]-3-phenyl-urea is C21H15N5O4S.
What is the molecular weight of 1-[4-(4-Nitro-phenyl)-3-oxo-2-phenyl-[1,2,4]thiadiazolidin-(5Z)-ylidene]-3-phenyl-urea?
The molecular weight of 1-[4-(4-Nitro-phenyl)-3-oxo-2-phenyl-[1,2,4]thiadiazolidin-(5Z)-ylidene]-3-phenyl-urea is 433.08447 g/mol.
Where can I buy 1-[4-(4-Nitro-phenyl)-3-oxo-2-phenyl-[1,2,4]thiadiazolidin-(5Z)-ylidene]-3-phenyl-urea?
You can request a quote for 1-[4-(4-Nitro-phenyl)-3-oxo-2-phenyl-[1,2,4]thiadiazolidin-(5Z)-ylidene]-3-phenyl-urea directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-[4-(4-Nitro-phenyl)-3-oxo-2-phenyl-[1,2,4]thiadiazolidin-(5Z)-ylidene]-3-phenyl-urea?
Yes, CoreyChem provides custom synthesis services for 1-[4-(4-Nitro-phenyl)-3-oxo-2-phenyl-[1,2,4]thiadiazolidin-(5Z)-ylidene]-3-phenyl-urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.