TL;DR: 4-Fluorophenyl N-(3-chlorophenyl)carbamate (CAS 126919-81-1) is a chemical compound with molecular formula C13H9ClFNO2 and molecular weight 265.03058 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4-fluorophenyl) N-(3-chlorophenyl)carbamate
Also Known As: 4-fluorophenyl N-(3-chlorophenyl)carbamate, (4-fluorophenyl) N-(3-chlorophenyl)carbamate, 666-324-5
| Molecular Formula | C13H9ClFNO2 |
| Molecular Weight | 265.03058 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 265.03058 Da |
| Heavy Atoms | 18 |
| Complexity | 282.0 |
| SMILES | C1=CC(=CC(=C1)Cl)NC(=O)OC2=CC=C(C=C2)F |
| InChIKey | AJHXCLAVCHULGK-UHFFFAOYSA-N |
The XLogP value of 4.0 indicates that 4-Fluorophenyl N-(3-chlorophenyl)carbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.3 Ų, 4-Fluorophenyl N-(3-chlorophenyl)carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Fluorophenyl N-(3-chlorophenyl)carbamate has 1 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 4-Fluorophenyl N-(3-chlorophenyl)carbamate is 126919-81-1.
The molecular formula of 4-Fluorophenyl N-(3-chlorophenyl)carbamate is C13H9ClFNO2.
The molecular weight of 4-Fluorophenyl N-(3-chlorophenyl)carbamate is 265.03058 g/mol.
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