5-Phenyl-6-oxa-1,8-diazatricyclo[7.3.0.03,7]dodeca-3(7),8-dien-2-one
TL;DR: 5-Phenyl-6-oxa-1,8-diazatricyclo[7.3.0.03,7]dodeca-3(7),8-dien-2-one (CAS 2420-35-1) is a chemical compound with molecular formula C15H14N2O2 and molecular weight 254.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-phenyl-6-oxa-1,8-diazatricyclo[7.3.0.03,7]dodeca-3(7),8-dien-2-one
Also Known As: 2-phenyl-3,6,7,8-tetrahydrofuro[2,3-d]pyrrolo[1,2-a]pyrimidin-4(2h)-one, 5-Phenyl-6-oxa-1,8-diazatricyclo[7.3.0.03,7]dodeca-3(7),8-dien-2-one
| Molecular Formula | C15H14N2O2 |
|---|---|
| Molecular Weight | 254.11 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 41.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 254.10553 |
| Heavy Atoms | 19 |
| Complexity | 475.0 |
Chemical Identifiers
| CAS Number | 2420-35-1 |
|---|---|
| SMILES | C1CC2=NC3=C(CC(O3)C4=CC=CC=C4)C(=O)N2C1 |
| InChIKey | SYVYWKNFTUCXBP-UHFFFAOYSA-N |
Product Overview
5-Phenyl-6-oxa-1,8-diazatricyclo[7.3.0.03,7]dodeca-3(7),8-dien-2-one (CAS 2420-35-1), with molecular formula C15H14N2O2 and molecular weight 254.11 g/mol. IUPAC: 5-phenyl-6-oxa-1,8-diazatricyclo[7.3.0.03,7]dodeca-3(7),8-dien-2-one.
Chemical Property Profile of 5-Phenyl-6-oxa-1,8-diazatricyclo[7.3.0.03,7]dodeca-3(7),8-dien-2-one
Property Insights of 5-Phenyl-6-oxa-1,8-diazatricyclo[7.3.0.03,7]dodeca-3(7),8-dien-2-one
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Phenyl-6-oxa-1,8-diazatricyclo[7.3.0.03,7]dodeca-3(7),8-dien-2-one. With a topological polar surface area (TPSA) of 41.9 Ų, 5-Phenyl-6-oxa-1,8-diazatricyclo[7.3.0.03,7]dodeca-3(7),8-dien-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Phenyl-6-oxa-1,8-diazatricyclo[7.3.0.03,7]dodeca-3(7),8-dien-2-one 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 5-Phenyl-6-oxa-1,8-diazatricyclo[7.3.0.03,7]dodeca-3(7),8-dien-2-one?
The CAS number of 5-Phenyl-6-oxa-1,8-diazatricyclo[7.3.0.03,7]dodeca-3(7),8-dien-2-one is 2420-35-1.
What is the molecular formula of 5-Phenyl-6-oxa-1,8-diazatricyclo[7.3.0.03,7]dodeca-3(7),8-dien-2-one?
The molecular formula of 5-Phenyl-6-oxa-1,8-diazatricyclo[7.3.0.03,7]dodeca-3(7),8-dien-2-one is C15H14N2O2.
What is the molecular weight of 5-Phenyl-6-oxa-1,8-diazatricyclo[7.3.0.03,7]dodeca-3(7),8-dien-2-one?
The molecular weight of 5-Phenyl-6-oxa-1,8-diazatricyclo[7.3.0.03,7]dodeca-3(7),8-dien-2-one is 254.11 g/mol.
Where can I buy 5-Phenyl-6-oxa-1,8-diazatricyclo[7.3.0.03,7]dodeca-3(7),8-dien-2-one?
You can request a quote for 5-Phenyl-6-oxa-1,8-diazatricyclo[7.3.0.03,7]dodeca-3(7),8-dien-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Phenyl-6-oxa-1,8-diazatricyclo[7.3.0.03,7]dodeca-3(7),8-dien-2-one?
Yes, KEHONG BIO provides custom synthesis services for 5-Phenyl-6-oxa-1,8-diazatricyclo[7.3.0.03,7]dodeca-3(7),8-dien-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.