![4-[(4-hydroxyphenyl)methyl]-2,2-diphenyl-1-oxa-3-azonia-2-boranuidacyclopentan-5-one structure](/static/products/2654/26546-31-6.webp)
4-[(4-hydroxyphenyl)methyl]-2,2-diphenyl-1-oxa-3-azonia-2-boranuidacyclopentan-5-one
TL;DR: 4-[(4-hydroxyphenyl)methyl]-2,2-diphenyl-1-oxa-3-azonia-2-boranuidacyclopentan-5-one (CAS 26546-31-6) is a chemical compound with molecular formula C21H20BNO3 and molecular weight 345.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(4-hydroxyphenyl)methyl]-2,2-diphenyl-1-oxa-3-azonia-2-boranuidacyclopentan-5-one
Also Known As: 4-[(4-hydroxyphenyl)methyl]-2,2-diphenyl-1-oxa-3-azonia-2-boranuidacyclopentan-5-one, [2-(Amino-kappaN)-3-(4-hydroxyphenyl)propanoato-kappaO]diphenylboron
| Molecular Formula | C21H20BNO3 |
|---|---|
| Molecular Weight | 345.15 g/mol |
| LogP | 0.6801 |
| Topological Polar Surface Area | 63.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 345.15363 |
| Heavy Atoms | 26 |
| Complexity | 462.0 |
Chemical Identifiers
| CAS Number | 26546-31-6 |
|---|---|
| SMILES | [B-]1([NH2+]C(C(=O)O1)CC2=CC=C(C=C2)O)(C3=CC=CC=C3)C4=CC=CC=C4 |
| InChIKey | IKDPYWDEXJJEQP-UHFFFAOYSA-N |
Product Overview
4-[(4-hydroxyphenyl)methyl]-2,2-diphenyl-1-oxa-3-azonia-2-boranuidacyclopentan-5-one (CAS 26546-31-6), with molecular formula C21H20BNO3 and molecular weight 345.15 g/mol. IUPAC: 4-[(4-hydroxyphenyl)methyl]-2,2-diphenyl-1-oxa-3-azonia-2-boranuidacyclopentan-5-one.
Chemical Property Profile of 4-[(4-hydroxyphenyl)methyl]-2,2-diphenyl-1-oxa-3-azonia-2-boranuidacyclopentan-5-one
Property Insights of 4-[(4-hydroxyphenyl)methyl]-2,2-diphenyl-1-oxa-3-azonia-2-boranuidacyclopentan-5-one
The XLogP value of 0.6801 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(4-hydroxyphenyl)methyl]-2,2-diphenyl-1-oxa-3-azonia-2-boranuidacyclopentan-5-one. The TPSA of 63.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(4-hydroxyphenyl)methyl]-2,2-diphenyl-1-oxa-3-azonia-2-boranuidacyclopentan-5-one. Following Lipinski's Rule of Five, 4-[(4-hydroxyphenyl)methyl]-2,2-diphenyl-1-oxa-3-azonia-2-boranuidacyclopentan-5-one has 2 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 4-[(4-hydroxyphenyl)methyl]-2,2-diphenyl-1-oxa-3-azonia-2-boranuidacyclopentan-5-one?
The CAS number of 4-[(4-hydroxyphenyl)methyl]-2,2-diphenyl-1-oxa-3-azonia-2-boranuidacyclopentan-5-one is 26546-31-6.
What is the molecular formula of 4-[(4-hydroxyphenyl)methyl]-2,2-diphenyl-1-oxa-3-azonia-2-boranuidacyclopentan-5-one?
The molecular formula of 4-[(4-hydroxyphenyl)methyl]-2,2-diphenyl-1-oxa-3-azonia-2-boranuidacyclopentan-5-one is C21H20BNO3.
What is the molecular weight of 4-[(4-hydroxyphenyl)methyl]-2,2-diphenyl-1-oxa-3-azonia-2-boranuidacyclopentan-5-one?
The molecular weight of 4-[(4-hydroxyphenyl)methyl]-2,2-diphenyl-1-oxa-3-azonia-2-boranuidacyclopentan-5-one is 345.15 g/mol.
Where can I buy 4-[(4-hydroxyphenyl)methyl]-2,2-diphenyl-1-oxa-3-azonia-2-boranuidacyclopentan-5-one?
You can request a quote for 4-[(4-hydroxyphenyl)methyl]-2,2-diphenyl-1-oxa-3-azonia-2-boranuidacyclopentan-5-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(4-hydroxyphenyl)methyl]-2,2-diphenyl-1-oxa-3-azonia-2-boranuidacyclopentan-5-one?
Yes, KEHONG BIO provides custom synthesis services for 4-[(4-hydroxyphenyl)methyl]-2,2-diphenyl-1-oxa-3-azonia-2-boranuidacyclopentan-5-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.