ChemDiv1_006094
TL;DR: ChemDiv1_006094 (CAS 355414-86-7) is a chemical compound with molecular formula C17H18N6O3 and molecular weight 354.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-yl)-5-(3-methylpiperidin-1-yl)-[1,2,5]oxadiazolo[3,4-b]pyrazin-6-amine
Also Known As: ChemDiv1_006094, AN-465/13859068, A2330/0098338, N-(1,3-benzodioxol-5-yl)-5-(3-methylpiperidin-1-yl)-[1,2,5]oxadiazolo[3,4-b]pyrazin-6-amine, N-(1,3-benzodioxol-5-yl)-6-(3-methylpiperidin-1-yl)[1,2,5]oxadiazolo[3,4-b]pyrazin-5-amine
| Molecular Formula | C17H18N6O3 |
|---|---|
| Molecular Weight | 354.14 g/mol |
| LogP | 2.7214 |
| Topological Polar Surface Area | 98.43 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 354.14404 |
| Heavy Atoms | 26 |
| Complexity | 958.8212 |
Chemical Identifiers
| CAS Number | 355414-86-7 |
|---|---|
| SMILES | CC1CCCN(C1)C2=NC3=NON=C3N=C2NC4=CC5=C(C=C4)OCO5 |
Product Overview
ChemDiv1_006094 (CAS 355414-86-7), with molecular formula C17H18N6O3 and molecular weight 354.14 g/mol. IUPAC: N-(1,3-benzodioxol-5-yl)-5-(3-methylpiperidin-1-yl)-[1,2,5]oxadiazolo[3,4-b]pyrazin-6-amine.
Chemical Property Profile of ChemDiv1_006094
Property Insights of ChemDiv1_006094
The XLogP value of 2.7214 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv1_006094. The TPSA of 98.43 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_006094. Following Lipinski's Rule of Five, ChemDiv1_006094 has 1 hydrogen bond donor(s) and 9 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 ChemDiv1_006094?
The CAS number of ChemDiv1_006094 is 355414-86-7.
What is the molecular formula of ChemDiv1_006094?
The molecular formula of ChemDiv1_006094 is C17H18N6O3.
What is the molecular weight of ChemDiv1_006094?
The molecular weight of ChemDiv1_006094 is 354.14 g/mol.
Where can I buy ChemDiv1_006094?
You can request a quote for ChemDiv1_006094 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_006094?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_006094 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.