TL;DR: 1-(4-(4-Bromophenylazo)phenyl)aziridine (CAS 145764-91-6) is a chemical compound with molecular formula C14H12BrN3 and molecular weight 301.02145 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[4-(aziridin-1-yl)phenyl]-(4-bromophenyl)diazene
Also Known As: 1-(4-(4-BROMOPHENYLAZO)PHENYL)AZIRIDINE, 4-(Aziridin-1-yl)-4 -bromoazobenzene, [4-(aziridin-1-yl)phenyl]-(4-bromophenyl)diazene, 1-{4-[(4-Bromophenyl)diazenyl]phenyl}aziridine, 1-{4-[2-(4-BROMOPHENYL)DIAZEN-1-YL]PHENYL}AZIRIDINE
| Molecular Formula | C14H12BrN3 |
| Molecular Weight | 301.02145 g/mol |
| XLogP | 4.3 |
| Topological Polar Surface Area (TPSA) | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 301.02145 Da |
| Heavy Atoms | 18 |
| Complexity | 287.0 |
| SMILES | C1CN1C2=CC=C(C=C2)N=NC3=CC=C(C=C3)Br |
| InChIKey | KSGKOILCMAOPBJ-UHFFFAOYSA-N |
The XLogP value of 4.3 indicates that 1-(4-(4-Bromophenylazo)phenyl)aziridine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.7 Ų, 1-(4-(4-Bromophenylazo)phenyl)aziridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-(4-Bromophenylazo)phenyl)aziridine has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-(4-(4-Bromophenylazo)phenyl)aziridine is 145764-91-6.
The molecular formula of 1-(4-(4-Bromophenylazo)phenyl)aziridine is C14H12BrN3.
The molecular weight of 1-(4-(4-Bromophenylazo)phenyl)aziridine is 301.02145 g/mol.
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