2(3H)-Benzoxazolone, 6-(1-oxo-5-phenyl-2,4-pentadienyl)-
TL;DR: 2(3H)-Benzoxazolone, 6-(1-oxo-5-phenyl-2,4-pentadienyl)- (CAS 54903-27-4) is a chemical compound with molecular formula C18H13NO3 and molecular weight 291.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[(2E,4E)-5-phenylpenta-2,4-dienoyl]-3H-1,3-benzoxazol-2-one
Also Known As: 2(3H)-Benzoxazolone, 6-(1-oxo-5-phenyl-2,4-pentadienyl)-, 6-(1-Oxo-5-phenyl-2,4-pentadienyl)-2(3H)-benzoxazolone, 6-[(2E,4E)-5-phenylpenta-2,4-dienoyl]-3H-1,3-benzoxazol-2-one, RefChem:1058717, BRN 1218031
| Molecular Formula | C18H13NO3 |
|---|---|
| Molecular Weight | 291.09 g/mol |
| LogP | 3.5734 |
| Topological Polar Surface Area | 63.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 291.08954 |
| Heavy Atoms | 22 |
| Complexity | 914.1602 |
Chemical Identifiers
| CAS Number | 54903-27-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C=C/C=C/C(=O)C2=CC3=C(C=C2)NC(=O)O3 |
Product Overview
2(3H)-Benzoxazolone, 6-(1-oxo-5-phenyl-2,4-pentadienyl)- (CAS 54903-27-4), with molecular formula C18H13NO3 and molecular weight 291.09 g/mol. IUPAC: 6-[(2E,4E)-5-phenylpenta-2,4-dienoyl]-3H-1,3-benzoxazol-2-one.
Chemical Property Profile of 2(3H)-Benzoxazolone, 6-(1-oxo-5-phenyl-2,4-pentadienyl)-
Property Insights of 2(3H)-Benzoxazolone, 6-(1-oxo-5-phenyl-2,4-pentadienyl)-
The XLogP value of 3.5734 indicates that 2(3H)-Benzoxazolone, 6-(1-oxo-5-phenyl-2,4-pentadienyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.07 Ų falls within the moderate polarity range, balancing permeability and solubility for 2(3H)-Benzoxazolone, 6-(1-oxo-5-phenyl-2,4-pentadienyl)-. Following Lipinski's Rule of Five, 2(3H)-Benzoxazolone, 6-(1-oxo-5-phenyl-2,4-pentadienyl)- 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 2(3H)-Benzoxazolone, 6-(1-oxo-5-phenyl-2,4-pentadienyl)-?
The CAS number of 2(3H)-Benzoxazolone, 6-(1-oxo-5-phenyl-2,4-pentadienyl)- is 54903-27-4.
What is the molecular formula of 2(3H)-Benzoxazolone, 6-(1-oxo-5-phenyl-2,4-pentadienyl)-?
The molecular formula of 2(3H)-Benzoxazolone, 6-(1-oxo-5-phenyl-2,4-pentadienyl)- is C18H13NO3.
What is the molecular weight of 2(3H)-Benzoxazolone, 6-(1-oxo-5-phenyl-2,4-pentadienyl)-?
The molecular weight of 2(3H)-Benzoxazolone, 6-(1-oxo-5-phenyl-2,4-pentadienyl)- is 291.09 g/mol.
Where can I buy 2(3H)-Benzoxazolone, 6-(1-oxo-5-phenyl-2,4-pentadienyl)-?
You can request a quote for 2(3H)-Benzoxazolone, 6-(1-oxo-5-phenyl-2,4-pentadienyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2(3H)-Benzoxazolone, 6-(1-oxo-5-phenyl-2,4-pentadienyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2(3H)-Benzoxazolone, 6-(1-oxo-5-phenyl-2,4-pentadienyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.