2(3H)-Benzoxazolone, 6-(3-(4-chlorophenyl)-1-oxopropyl)-
TL;DR: 2(3H)-Benzoxazolone, 6-(3-(4-chlorophenyl)-1-oxopropyl)- (CAS 54903-32-1) is a chemical compound with molecular formula C16H12ClNO3 and molecular weight 301.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[3-(4-chlorophenyl)propanoyl]-3H-1,3-benzoxazol-2-one
Also Known As: 2(3H)-Benzoxazolone, 6-(3-(4-chlorophenyl)-1-oxopropyl)-, 6-(3-(4-Chlorophenyl)-1-oxopropyl)-2(3H)-benzoxazolone, 6-[3-(4-chlorophenyl)propanoyl]-3H-1,3-benzoxazol-2-one, 6-[3-(4-Chlorophenyl)propanoyl]-1,3-benzoxazol-2(3H)-one, BRN 1140886
| Molecular Formula | C16H12ClNO3 |
|---|---|
| Molecular Weight | 301.05 g/mol |
| LogP | 3.59 |
| Topological Polar Surface Area | 63.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 301.05057 |
| Heavy Atoms | 21 |
| Complexity | 845.83466 |
Chemical Identifiers
| CAS Number | 54903-32-1 |
|---|---|
| SMILES | C1=CC(=CC=C1CCC(=O)C2=CC3=C(C=C2)NC(=O)O3)Cl |
Product Overview
2(3H)-Benzoxazolone, 6-(3-(4-chlorophenyl)-1-oxopropyl)- (CAS 54903-32-1), with molecular formula C16H12ClNO3 and molecular weight 301.05 g/mol. IUPAC: 6-[3-(4-chlorophenyl)propanoyl]-3H-1,3-benzoxazol-2-one.
Chemical Property Profile of 2(3H)-Benzoxazolone, 6-(3-(4-chlorophenyl)-1-oxopropyl)-
Property Insights of 2(3H)-Benzoxazolone, 6-(3-(4-chlorophenyl)-1-oxopropyl)-
The XLogP value of 3.59 indicates that 2(3H)-Benzoxazolone, 6-(3-(4-chlorophenyl)-1-oxopropyl)- 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-(3-(4-chlorophenyl)-1-oxopropyl)-. Following Lipinski's Rule of Five, 2(3H)-Benzoxazolone, 6-(3-(4-chlorophenyl)-1-oxopropyl)- 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-(3-(4-chlorophenyl)-1-oxopropyl)-?
The CAS number of 2(3H)-Benzoxazolone, 6-(3-(4-chlorophenyl)-1-oxopropyl)- is 54903-32-1.
What is the molecular formula of 2(3H)-Benzoxazolone, 6-(3-(4-chlorophenyl)-1-oxopropyl)-?
The molecular formula of 2(3H)-Benzoxazolone, 6-(3-(4-chlorophenyl)-1-oxopropyl)- is C16H12ClNO3.
What is the molecular weight of 2(3H)-Benzoxazolone, 6-(3-(4-chlorophenyl)-1-oxopropyl)-?
The molecular weight of 2(3H)-Benzoxazolone, 6-(3-(4-chlorophenyl)-1-oxopropyl)- is 301.05 g/mol.
Where can I buy 2(3H)-Benzoxazolone, 6-(3-(4-chlorophenyl)-1-oxopropyl)-?
You can request a quote for 2(3H)-Benzoxazolone, 6-(3-(4-chlorophenyl)-1-oxopropyl)- 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-(3-(4-chlorophenyl)-1-oxopropyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2(3H)-Benzoxazolone, 6-(3-(4-chlorophenyl)-1-oxopropyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.