Deoxyvasicinone
TL;DR: Deoxyvasicinone (CAS 530-53-0) is a chemical compound with molecular formula C11H10N2O and molecular weight 186.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-dihydro-1H-pyrrolo[2,1-b]quinazolin-9-one
Also Known As: Deoxyvasicinone, Pegenone, 2,3-Trimethylene-4-quinazolone, Deoxypeganine, Deoxyvasicione
| Molecular Formula | C11H10N2O |
|---|---|
| Molecular Weight | 186.08 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 32.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 186.07932 |
| Heavy Atoms | 14 |
| Complexity | 298.0 |
Chemical Identifiers
| CAS Number | 530-53-0 |
|---|---|
| SMILES | C1CC2=NC3=CC=CC=C3C(=O)N2C1 |
| InChIKey | VARHXCYGZKSOOO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Deoxyvasicinone (CAS 530-53-0), with molecular formula C11H10N2O and molecular weight 186.08 g/mol. IUPAC: 2,3-dihydro-1H-pyrrolo[2,1-b]quinazolin-9-one.
Chemical Property Profile of Deoxyvasicinone
Property Insights of Deoxyvasicinone
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Deoxyvasicinone. With a topological polar surface area (TPSA) of 32.7 Ų, Deoxyvasicinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Deoxyvasicinone has 0 hydrogen bond donor(s) and 2 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 Deoxyvasicinone?
The CAS number of Deoxyvasicinone is 530-53-0.
What is the molecular formula of Deoxyvasicinone?
The molecular formula of Deoxyvasicinone is C11H10N2O.
What is the molecular weight of Deoxyvasicinone?
The molecular weight of Deoxyvasicinone is 186.08 g/mol.
Where can I buy Deoxyvasicinone?
You can request a quote for Deoxyvasicinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Deoxyvasicinone?
Yes, KEHONG BIO provides custom synthesis services for Deoxyvasicinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.