2H-1-Benzopyran-2-one, 3-(2-benzoxazolyl)-
TL;DR: 2H-1-Benzopyran-2-one, 3-(2-benzoxazolyl)- (CAS 17577-47-8) is a chemical compound with molecular formula C16H9NO3 and molecular weight 263.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1,3-benzoxazol-2-yl)chromen-2-one
Also Known As: 3-(2'-benzoxazolyl)coumarin, 2H-1-Benzopyran-2-one, 3-(2-benzoxazolyl)-, 3-(benzo[d]oxazol-2-yl)-2H-chromen-2-one, IFLab1_000377, 3-(1,3-benzoxazol-2-yl)-2H-chromen-2-one
| Molecular Formula | C16H9NO3 |
|---|---|
| Molecular Weight | 263.06 g/mol |
| LogP | 3.6012 |
| Topological Polar Surface Area | 56.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 263.05826 |
| Heavy Atoms | 20 |
| Complexity | 948.52545 |
Chemical Identifiers
| CAS Number | 17577-47-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C(C(=O)O2)C3=NC4=CC=CC=C4O3 |
Product Overview
2H-1-Benzopyran-2-one, 3-(2-benzoxazolyl)- (CAS 17577-47-8), with molecular formula C16H9NO3 and molecular weight 263.06 g/mol. IUPAC: 3-(1,3-benzoxazol-2-yl)chromen-2-one.
Chemical Property Profile of 2H-1-Benzopyran-2-one, 3-(2-benzoxazolyl)-
Property Insights of 2H-1-Benzopyran-2-one, 3-(2-benzoxazolyl)-
The XLogP value of 3.6012 indicates that 2H-1-Benzopyran-2-one, 3-(2-benzoxazolyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.24 Ų, 2H-1-Benzopyran-2-one, 3-(2-benzoxazolyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2H-1-Benzopyran-2-one, 3-(2-benzoxazolyl)- has 0 hydrogen bond donor(s) and 4 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 2H-1-Benzopyran-2-one, 3-(2-benzoxazolyl)-?
The CAS number of 2H-1-Benzopyran-2-one, 3-(2-benzoxazolyl)- is 17577-47-8.
What is the molecular formula of 2H-1-Benzopyran-2-one, 3-(2-benzoxazolyl)-?
The molecular formula of 2H-1-Benzopyran-2-one, 3-(2-benzoxazolyl)- is C16H9NO3.
What is the molecular weight of 2H-1-Benzopyran-2-one, 3-(2-benzoxazolyl)-?
The molecular weight of 2H-1-Benzopyran-2-one, 3-(2-benzoxazolyl)- is 263.06 g/mol.
Where can I buy 2H-1-Benzopyran-2-one, 3-(2-benzoxazolyl)-?
You can request a quote for 2H-1-Benzopyran-2-one, 3-(2-benzoxazolyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-1-Benzopyran-2-one, 3-(2-benzoxazolyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2H-1-Benzopyran-2-one, 3-(2-benzoxazolyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.