6-chloro-3-(5-(3-hydroxynaphthalen-2-yl)-1,3,4-oxadiazol-2-yl)-2H-chromen-2-one
TL;DR: 6-chloro-3-(5-(3-hydroxynaphthalen-2-yl)-1,3,4-oxadiazol-2-yl)-2H-chromen-2-one (CAS 333773-31-2) is a chemical compound with molecular formula C21H11ClN2O4 and molecular weight 390.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-3-[5-(3-hydroxynaphthalen-2-yl)-1,3,4-oxadiazol-2-yl]chromen-2-one
Also Known As: BAS 01020161, 6-chloro-3-(5-(3-hydroxynaphthalen-2-yl)-1,3,4-oxadiazol-2-yl)-2H-chromen-2-one, 6-chloro-3-[(2E)-2-(3-oxonaphthalen-2-ylidene)-3H-1,3,4-oxadiazol-5-yl]chromen-2-one, 6-chloro-3-[2-(3-oxonaphthalen-2-ylidene)-3H-1,3,4-oxadiazol-5-yl]chromen-2-one, 6-chloro-3-[5-(3-hydroxy(2-naphthyl))(1,3,4-oxadiazol-2-yl)]chromen-2-one
| Molecular Formula | C21H11ClN2O4 |
|---|---|
| Molecular Weight | 390.04 g/mol |
| LogP | 5.0222 |
| Topological Polar Surface Area | 89.36 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 390.04074 |
| Heavy Atoms | 28 |
| Complexity | 1421.4127 |
Chemical Identifiers
| CAS Number | 333773-31-2 |
|---|---|
| SMILES | C1=CC=C2C=C(C(=CC2=C1)C3=NN=C(O3)C4=CC5=C(C=CC(=C5)Cl)OC4=O)O |
Product Overview
6-chloro-3-(5-(3-hydroxynaphthalen-2-yl)-1,3,4-oxadiazol-2-yl)-2H-chromen-2-one (CAS 333773-31-2), with molecular formula C21H11ClN2O4 and molecular weight 390.04 g/mol. IUPAC: 6-chloro-3-[5-(3-hydroxynaphthalen-2-yl)-1,3,4-oxadiazol-2-yl]chromen-2-one.
Chemical Property Profile of 6-chloro-3-(5-(3-hydroxynaphthalen-2-yl)-1,3,4-oxadiazol-2-yl)-2H-chromen-2-one
Property Insights of 6-chloro-3-(5-(3-hydroxynaphthalen-2-yl)-1,3,4-oxadiazol-2-yl)-2H-chromen-2-one
The XLogP value of 5.0222 indicates that 6-chloro-3-(5-(3-hydroxynaphthalen-2-yl)-1,3,4-oxadiazol-2-yl)-2H-chromen-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.36 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-chloro-3-(5-(3-hydroxynaphthalen-2-yl)-1,3,4-oxadiazol-2-yl)-2H-chromen-2-one. Following Lipinski's Rule of Five, 6-chloro-3-(5-(3-hydroxynaphthalen-2-yl)-1,3,4-oxadiazol-2-yl)-2H-chromen-2-one has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-chloro-3-(5-(3-hydroxynaphthalen-2-yl)-1,3,4-oxadiazol-2-yl)-2H-chromen-2-one?
The CAS number of 6-chloro-3-(5-(3-hydroxynaphthalen-2-yl)-1,3,4-oxadiazol-2-yl)-2H-chromen-2-one is 333773-31-2.
What is the molecular formula of 6-chloro-3-(5-(3-hydroxynaphthalen-2-yl)-1,3,4-oxadiazol-2-yl)-2H-chromen-2-one?
The molecular formula of 6-chloro-3-(5-(3-hydroxynaphthalen-2-yl)-1,3,4-oxadiazol-2-yl)-2H-chromen-2-one is C21H11ClN2O4.
What is the molecular weight of 6-chloro-3-(5-(3-hydroxynaphthalen-2-yl)-1,3,4-oxadiazol-2-yl)-2H-chromen-2-one?
The molecular weight of 6-chloro-3-(5-(3-hydroxynaphthalen-2-yl)-1,3,4-oxadiazol-2-yl)-2H-chromen-2-one is 390.04 g/mol.
Where can I buy 6-chloro-3-(5-(3-hydroxynaphthalen-2-yl)-1,3,4-oxadiazol-2-yl)-2H-chromen-2-one?
You can request a quote for 6-chloro-3-(5-(3-hydroxynaphthalen-2-yl)-1,3,4-oxadiazol-2-yl)-2H-chromen-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-chloro-3-(5-(3-hydroxynaphthalen-2-yl)-1,3,4-oxadiazol-2-yl)-2H-chromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 6-chloro-3-(5-(3-hydroxynaphthalen-2-yl)-1,3,4-oxadiazol-2-yl)-2H-chromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.