Diazene, 1-(4-isocyanatophenyl)-2-phenyl-
TL;DR: Diazene, 1-(4-isocyanatophenyl)-2-phenyl- (CAS 321951-62-6) is a chemical compound with molecular formula C13H9N3O and molecular weight 223.07455 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4-isocyanatophenyl)-phenyldiazene
Also Known As: p-Isocyanatoazobenzene, (E)-1-(4-isocyanatophenyl)-2-phenyldiazene, Diazene, (4-isocyanatophenyl)phenyl-, 4-Isocyanatoazobenzene, (4-isocyanatophenyl)-phenyldiazene
Application Areas
Top 5 of 8 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C13H9N3O |
| Molecular Weight | 223.07455 g/mol |
| XLogP | 4.9 |
| Topological Polar Surface Area (TPSA) | 54.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 223.07455 Da |
| Heavy Atoms | 17 |
| Complexity | 296.0 |
| SMILES | C1=CC=C(C=C1)N=NC2=CC=C(C=C2)N=C=O |
| InChIKey | HICXYNWIRHBSKQ-UHFFFAOYSA-N |
Chemical Property Profile of Diazene, 1-(4-isocyanatophenyl)-2-phenyl-
Property Insights of Diazene, 1-(4-isocyanatophenyl)-2-phenyl-
The XLogP value of 4.9 indicates that Diazene, 1-(4-isocyanatophenyl)-2-phenyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.2 Ų, Diazene, 1-(4-isocyanatophenyl)-2-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diazene, 1-(4-isocyanatophenyl)-2-phenyl- has 0 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 Diazene, 1-(4-isocyanatophenyl)-2-phenyl-?
The CAS number of Diazene, 1-(4-isocyanatophenyl)-2-phenyl- is 321951-62-6.
What is the molecular formula of Diazene, 1-(4-isocyanatophenyl)-2-phenyl-?
The molecular formula of Diazene, 1-(4-isocyanatophenyl)-2-phenyl- is C13H9N3O.
What is the molecular weight of Diazene, 1-(4-isocyanatophenyl)-2-phenyl-?
The molecular weight of Diazene, 1-(4-isocyanatophenyl)-2-phenyl- is 223.07455 g/mol.
Where can I buy Diazene, 1-(4-isocyanatophenyl)-2-phenyl-?
You can request a quote for Diazene, 1-(4-isocyanatophenyl)-2-phenyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Diazene, 1-(4-isocyanatophenyl)-2-phenyl-?
Yes, CoreyChem provides custom synthesis services for Diazene, 1-(4-isocyanatophenyl)-2-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.