Bionet2_001417
TL;DR: Bionet2_001417 (CAS 1008710-16-4) is a chemical compound with molecular formula C20H19N3O and molecular weight 317.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(4-methylphenyl)methyl]-4-oxo-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoxaline-7-carbonitrile
Also Known As: Bionet2_001417, 5-(4-methylbenzyl)-4-oxo-1,2,3,3a,4,5-hexahydropyrrolo[1,2-a]quinoxaline-7-carbonitrile, 5-[(4-methylphenyl)methyl]-4-oxo-1H,2H,3H,3aH,4H,5H-pyrrolo[1,2-a]quinoxaline-7-carbonitrile, 5-[(4-methylphenyl)methyl]-4-oxo-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoxaline-7-carbonitrile, Pyrrolo[1,2-a]quinoxaline-7-carbonitrile, 1,2,3,3a,4,5-hexahydro-5-[(4-methylphenyl)methyl]-4-oxo-
| Molecular Formula | C20H19N3O |
|---|---|
| Molecular Weight | 317.15 g/mol |
| LogP | 3.3823 |
| Topological Polar Surface Area | 47.34 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 317.1528 |
| Heavy Atoms | 24 |
| Complexity | 834.95276 |
Chemical Identifiers
| CAS Number | 1008710-16-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CN2C3=C(C=CC(=C3)C#N)N4CCCC4C2=O |
Product Overview
Bionet2_001417 (CAS 1008710-16-4), with molecular formula C20H19N3O and molecular weight 317.15 g/mol. IUPAC: 5-[(4-methylphenyl)methyl]-4-oxo-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoxaline-7-carbonitrile.
Chemical Property Profile of Bionet2_001417
Property Insights of Bionet2_001417
The XLogP value of 3.3823 indicates that Bionet2_001417 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.34 Ų, Bionet2_001417 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bionet2_001417 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 Bionet2_001417?
The CAS number of Bionet2_001417 is 1008710-16-4.
What is the molecular formula of Bionet2_001417?
The molecular formula of Bionet2_001417 is C20H19N3O.
What is the molecular weight of Bionet2_001417?
The molecular weight of Bionet2_001417 is 317.15 g/mol.
Where can I buy Bionet2_001417?
You can request a quote for Bionet2_001417 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet2_001417?
Yes, KEHONG BIO provides custom synthesis services for Bionet2_001417 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.