4-苄氧基苯基氨基甲酸正丁酯
TL;DR: 4-苄氧基苯基氨基甲酸正丁酯 (CAS 195140-79-5) is a chemical compound with molecular formula C18H21NO3 and molecular weight 299.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-苄氧基苯基氨基甲酸正丁酯
(4-phenylmethoxyphenyl) N-butylcarbamate
Also Known As: FAAH Inhibitor I, URB532, 4-Benzyloxyphenyl-n-butylcarbamate, Urb 532, 4-(benzyloxy)phenyl butylcarbamate
| Molecular Formula | C18H21NO3 |
|---|---|
| Molecular Weight | 299.15 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 47.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 299.15213 |
| Heavy Atoms | 22 |
| Complexity | 307.0 |
Chemical Identifiers
| CAS Number | 195140-79-5 |
|---|---|
| SMILES | CCCCNC(=O)OC1=CC=C(C=C1)OCC2=CC=CC=C2 |
| InChIKey | HWXVDEAMULKKDC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-苄氧基苯基氨基甲酸正丁酯 (CAS 195140-79-5), with molecular formula C18H21NO3 and molecular weight 299.15 g/mol. IUPAC: (4-phenylmethoxyphenyl) N-butylcarbamate.
Chemical Property Profile of 4-苄氧基苯基氨基甲酸正丁酯
Property Insights of 4-苄氧基苯基氨基甲酸正丁酯
The XLogP value of 4.2 indicates that 4-苄氧基苯基氨基甲酸正丁酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.6 Ų, 4-苄氧基苯基氨基甲酸正丁酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-苄氧基苯基氨基甲酸正丁酯 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-苄氧基苯基氨基甲酸正丁酯?
The CAS number of 4-苄氧基苯基氨基甲酸正丁酯 is 195140-79-5.
What is the molecular formula of 4-苄氧基苯基氨基甲酸正丁酯?
The molecular formula of 4-苄氧基苯基氨基甲酸正丁酯 is C18H21NO3.
What is the molecular weight of 4-苄氧基苯基氨基甲酸正丁酯?
The molecular weight of 4-苄氧基苯基氨基甲酸正丁酯 is 299.15 g/mol.
Where can I buy 4-苄氧基苯基氨基甲酸正丁酯?
You can request a quote for 4-苄氧基苯基氨基甲酸正丁酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-苄氧基苯基氨基甲酸正丁酯?
Yes, KEHONG BIO provides custom synthesis services for 4-苄氧基苯基氨基甲酸正丁酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.