![1-(7,7-Diphenyl-6-oxa-2,4-diazabicyclo[3.2.0]hept-2-en-4-yl)ethanone structure](/static/products/5921/59213-03-5.webp)
1-(7,7-Diphenyl-6-oxa-2,4-diazabicyclo[3.2.0]hept-2-en-4-yl)ethanone
TL;DR: 1-(7,7-Diphenyl-6-oxa-2,4-diazabicyclo[3.2.0]hept-2-en-4-yl)ethanone (CAS 59213-03-5) is a chemical compound with molecular formula C18H16N2O2 and molecular weight 292.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(7,7-diphenyl-6-oxa-2,4-diazabicyclo[3.2.0]hept-2-en-4-yl)ethanone
Also Known As: 4-Acetyl-7,7-diphenyl-6-oxa-2,4-diazabicyclo[3.2.0]hept-2-ene, 1-(7,7-diphenyl-6-oxa-2,4-diazabicyclo[3.2.0]hept-2-en-4-yl)ethanone, 1-(7,7-Diphenyl-6-oxa-2,4-diazabicyclo(3.2.0)hept-2-en-4-yl)ethanone, 1-(7,7-Diphenyl-6-oxa-2,4-diazabicyclo[3.2.0]hept-2-en-4-yl)ethan-1-one, 1-{7,7-diphenyl-6-oxa-2,4-diazabicyclo[3.2.0]hept-2-en-4-yl}ethan-1-one
| Molecular Formula | C18H16N2O2 |
|---|---|
| Molecular Weight | 292.12 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 41.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 292.1212 |
| Heavy Atoms | 22 |
| Complexity | 446.0 |
Chemical Identifiers
| CAS Number | 59213-03-5 |
|---|---|
| SMILES | CC(=O)N1C=NC2C1OC2(C3=CC=CC=C3)C4=CC=CC=C4 |
| InChIKey | CRPNVMOOBIZMPU-UHFFFAOYSA-N |
Product Overview
1-(7,7-Diphenyl-6-oxa-2,4-diazabicyclo[3.2.0]hept-2-en-4-yl)ethanone (CAS 59213-03-5), with molecular formula C18H16N2O2 and molecular weight 292.12 g/mol. IUPAC: 1-(7,7-diphenyl-6-oxa-2,4-diazabicyclo[3.2.0]hept-2-en-4-yl)ethanone.
Chemical Property Profile of 1-(7,7-Diphenyl-6-oxa-2,4-diazabicyclo[3.2.0]hept-2-en-4-yl)ethanone
Property Insights of 1-(7,7-Diphenyl-6-oxa-2,4-diazabicyclo[3.2.0]hept-2-en-4-yl)ethanone
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(7,7-Diphenyl-6-oxa-2,4-diazabicyclo[3.2.0]hept-2-en-4-yl)ethanone. With a topological polar surface area (TPSA) of 41.9 Ų, 1-(7,7-Diphenyl-6-oxa-2,4-diazabicyclo[3.2.0]hept-2-en-4-yl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(7,7-Diphenyl-6-oxa-2,4-diazabicyclo[3.2.0]hept-2-en-4-yl)ethanone has 0 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 1-(7,7-Diphenyl-6-oxa-2,4-diazabicyclo[3.2.0]hept-2-en-4-yl)ethanone?
The CAS number of 1-(7,7-Diphenyl-6-oxa-2,4-diazabicyclo[3.2.0]hept-2-en-4-yl)ethanone is 59213-03-5.
What is the molecular formula of 1-(7,7-Diphenyl-6-oxa-2,4-diazabicyclo[3.2.0]hept-2-en-4-yl)ethanone?
The molecular formula of 1-(7,7-Diphenyl-6-oxa-2,4-diazabicyclo[3.2.0]hept-2-en-4-yl)ethanone is C18H16N2O2.
What is the molecular weight of 1-(7,7-Diphenyl-6-oxa-2,4-diazabicyclo[3.2.0]hept-2-en-4-yl)ethanone?
The molecular weight of 1-(7,7-Diphenyl-6-oxa-2,4-diazabicyclo[3.2.0]hept-2-en-4-yl)ethanone is 292.12 g/mol.
Where can I buy 1-(7,7-Diphenyl-6-oxa-2,4-diazabicyclo[3.2.0]hept-2-en-4-yl)ethanone?
You can request a quote for 1-(7,7-Diphenyl-6-oxa-2,4-diazabicyclo[3.2.0]hept-2-en-4-yl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(7,7-Diphenyl-6-oxa-2,4-diazabicyclo[3.2.0]hept-2-en-4-yl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(7,7-Diphenyl-6-oxa-2,4-diazabicyclo[3.2.0]hept-2-en-4-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.