J1.541.947D
TL;DR: J1.541.947D (CAS 345631-76-7) is a chemical compound with molecular formula C12H14N4O4 and molecular weight 278.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-oxo-3-pyrazin-2-yl-1,2,4-oxadiazol-4-yl)methyl 2,2-dimethylpropanoate
Also Known As: J1.541.947D, Propanoic acid, 2,2-dimethyl-, (5-oxo-3-pyrazinyl-1,2,4-oxadiazol-4(5H)-yl)methyl ester, (5-oxo-3-pyrazin-2-yl-1,2,4-oxadiazol-4-yl)methyl 2,2-dimethylpropanoate, 4-(Pivaloyloxymethyl)-3-(2-pyrazinyl)-1,2,4-oxadiazole-5(4H)-one, [5-Oxo-3-(pyrazin-2-yl)-1,2,4-oxadiazol-4(5H)-yl]methyl 2,2-dimethylpropanoate
| Molecular Formula | C12H14N4O4 |
|---|---|
| Molecular Weight | 278.10 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 94.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 278.1015 |
| Heavy Atoms | 20 |
| Complexity | 430.0 |
Chemical Identifiers
| CAS Number | 345631-76-7 |
|---|---|
| SMILES | CC(C)(C)C(=O)OCN1C(=NOC1=O)C2=NC=CN=C2 |
| InChIKey | PDCUJMDUVXJZRQ-UHFFFAOYSA-N |
Product Overview
J1.541.947D (CAS 345631-76-7), with molecular formula C12H14N4O4 and molecular weight 278.10 g/mol. IUPAC: (5-oxo-3-pyrazin-2-yl-1,2,4-oxadiazol-4-yl)methyl 2,2-dimethylpropanoate.
Chemical Property Profile of J1.541.947D
Property Insights of J1.541.947D
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for J1.541.947D. The TPSA of 94.0 Ų falls within the moderate polarity range, balancing permeability and solubility for J1.541.947D. Following Lipinski's Rule of Five, J1.541.947D has 0 hydrogen bond donor(s) and 7 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 J1.541.947D?
The CAS number of J1.541.947D is 345631-76-7.
What is the molecular formula of J1.541.947D?
The molecular formula of J1.541.947D is C12H14N4O4.
What is the molecular weight of J1.541.947D?
The molecular weight of J1.541.947D is 278.10 g/mol.
Where can I buy J1.541.947D?
You can request a quote for J1.541.947D directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for J1.541.947D?
Yes, KEHONG BIO provides custom synthesis services for J1.541.947D and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.