![1-phenyl-3-[(2Z)-5-[(E)-2-phenylethenyl]-1,3,4-thiadiazol-2(3H)-ylidene]urea structure](/static/products/131/1313614-40-2.webp)
1-phenyl-3-[(2Z)-5-[(E)-2-phenylethenyl]-1,3,4-thiadiazol-2(3H)-ylidene]urea
TL;DR: 1-phenyl-3-[(2Z)-5-[(E)-2-phenylethenyl]-1,3,4-thiadiazol-2(3H)-ylidene]urea (CAS 1313614-40-2) is a chemical compound with molecular formula C17H14N4OS and molecular weight 322.08884 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-phenyl-3-[5-[(E)-2-phenylethenyl]-1,3,4-thiadiazol-2-yl]urea
Also Known As: BAS 00704407, BIM-0006772.P001, 1-Phenyl-3-(5-styryl-[1,3,4]thiadiazol-2-yl)-urea, (E)-1-phenyl-3-(5-styryl-1,3,4-thiadiazol-2-yl)urea, N-phenyl-N'-[5-(2-phenylvinyl)-1,3,4-thiadiazol-2-yl]urea
Technical Specifications
| Molecular Formula | C17H14N4OS |
| Molecular Weight | 322.08884 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 95.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 322.08884 Da |
| Heavy Atoms | 23 |
| Complexity | 405.0 |
| SMILES | C1=CC=C(C=C1)/C=C/C2=NN=C(S2)NC(=O)NC3=CC=CC=C3 |
| InChIKey | WURFELYUILOBLB-VAWYXSNFSA-N |
Chemical Property Profile of 1-phenyl-3-[(2Z)-5-[(E)-2-phenylethenyl]-1,3,4-thiadiazol-2(3H)-ylidene]urea
Property Insights of 1-phenyl-3-[(2Z)-5-[(E)-2-phenylethenyl]-1,3,4-thiadiazol-2(3H)-ylidene]urea
The XLogP value of 3.6 indicates that 1-phenyl-3-[(2Z)-5-[(E)-2-phenylethenyl]-1,3,4-thiadiazol-2(3H)-ylidene]urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-phenyl-3-[(2Z)-5-[(E)-2-phenylethenyl]-1,3,4-thiadiazol-2(3H)-ylidene]urea. Following Lipinski's Rule of Five, 1-phenyl-3-[(2Z)-5-[(E)-2-phenylethenyl]-1,3,4-thiadiazol-2(3H)-ylidene]urea has 2 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 1-phenyl-3-[(2Z)-5-[(E)-2-phenylethenyl]-1,3,4-thiadiazol-2(3H)-ylidene]urea?
The CAS number of 1-phenyl-3-[(2Z)-5-[(E)-2-phenylethenyl]-1,3,4-thiadiazol-2(3H)-ylidene]urea is 1313614-40-2.
What is the molecular formula of 1-phenyl-3-[(2Z)-5-[(E)-2-phenylethenyl]-1,3,4-thiadiazol-2(3H)-ylidene]urea?
The molecular formula of 1-phenyl-3-[(2Z)-5-[(E)-2-phenylethenyl]-1,3,4-thiadiazol-2(3H)-ylidene]urea is C17H14N4OS.
What is the molecular weight of 1-phenyl-3-[(2Z)-5-[(E)-2-phenylethenyl]-1,3,4-thiadiazol-2(3H)-ylidene]urea?
The molecular weight of 1-phenyl-3-[(2Z)-5-[(E)-2-phenylethenyl]-1,3,4-thiadiazol-2(3H)-ylidene]urea is 322.08884 g/mol.
Where can I buy 1-phenyl-3-[(2Z)-5-[(E)-2-phenylethenyl]-1,3,4-thiadiazol-2(3H)-ylidene]urea?
You can request a quote for 1-phenyl-3-[(2Z)-5-[(E)-2-phenylethenyl]-1,3,4-thiadiazol-2(3H)-ylidene]urea directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-phenyl-3-[(2Z)-5-[(E)-2-phenylethenyl]-1,3,4-thiadiazol-2(3H)-ylidene]urea?
Yes, CoreyChem provides custom synthesis services for 1-phenyl-3-[(2Z)-5-[(E)-2-phenylethenyl]-1,3,4-thiadiazol-2(3H)-ylidene]urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.