Benzoxazol-2(3H)-one, N-(4-fluorobenzyl)-
TL;DR: Benzoxazol-2(3H)-one, N-(4-fluorobenzyl)- (CAS 190074-23-8) is a chemical compound with molecular formula C14H10FNO2 and molecular weight 243.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(4-fluorophenyl)methyl]-1,3-benzoxazol-2-one
Also Known As: Benzoxazol-2(3H)-one, N-(4-fluorobenzyl)-, 3-(4-Fluorobenzyl)benzoxazol-2(3H)-one, 2(3H)-Benzoxazolone, 3-[(4-fluorophenyl)methyl]-, 3-(4-Fluorobenzyl)-1,3-benzoxazol-2(3H)-one #, 3-[(4-fluorophenyl)methyl]-1,3-benzoxazol-2-one
| Molecular Formula | C14H10FNO2 |
|---|---|
| Molecular Weight | 243.07 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 243.06955 |
| Heavy Atoms | 18 |
| Complexity | 315.0 |
Chemical Identifiers
| CAS Number | 190074-23-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N(C(=O)O2)CC3=CC=C(C=C3)F |
| InChIKey | QOLQGBVBGJVMLF-UHFFFAOYSA-N |
Product Overview
Benzoxazol-2(3H)-one, N-(4-fluorobenzyl)- (CAS 190074-23-8), with molecular formula C14H10FNO2 and molecular weight 243.07 g/mol. IUPAC: 3-[(4-fluorophenyl)methyl]-1,3-benzoxazol-2-one.
Chemical Property Profile of Benzoxazol-2(3H)-one, N-(4-fluorobenzyl)-
Property Insights of Benzoxazol-2(3H)-one, N-(4-fluorobenzyl)-
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoxazol-2(3H)-one, N-(4-fluorobenzyl)-. With a topological polar surface area (TPSA) of 29.5 Ų, Benzoxazol-2(3H)-one, N-(4-fluorobenzyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoxazol-2(3H)-one, N-(4-fluorobenzyl)- has 0 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 Benzoxazol-2(3H)-one, N-(4-fluorobenzyl)-?
The CAS number of Benzoxazol-2(3H)-one, N-(4-fluorobenzyl)- is 190074-23-8.
What is the molecular formula of Benzoxazol-2(3H)-one, N-(4-fluorobenzyl)-?
The molecular formula of Benzoxazol-2(3H)-one, N-(4-fluorobenzyl)- is C14H10FNO2.
What is the molecular weight of Benzoxazol-2(3H)-one, N-(4-fluorobenzyl)-?
The molecular weight of Benzoxazol-2(3H)-one, N-(4-fluorobenzyl)- is 243.07 g/mol.
Where can I buy Benzoxazol-2(3H)-one, N-(4-fluorobenzyl)-?
You can request a quote for Benzoxazol-2(3H)-one, N-(4-fluorobenzyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoxazol-2(3H)-one, N-(4-fluorobenzyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzoxazol-2(3H)-one, N-(4-fluorobenzyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.