ChemDiv3_010982
TL;DR: ChemDiv3_010982 (CAS 863448-05-9) is a chemical compound with molecular formula C17H25N5O2 and molecular weight 331.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-tert-butyl-4-oxopyrazolo[5,4-d]pyrimidin-5-yl)-N-cyclohexylacetamide
Also Known As: ChemDiv3_010982, IDI1_028540, F0679-0636, BRD-K18645696-001-01-4, 2-(1-(tert-butyl)-4-oxo-1H-pyrazolo[3,4-d]pyrimidin-5(4H)-yl)-N-cyclohexylacetamide
| Molecular Formula | C17H25N5O2 |
|---|---|
| Molecular Weight | 331.20 g/mol |
| LogP | 1.7969 |
| Topological Polar Surface Area | 81.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 331.20084 |
| Heavy Atoms | 24 |
| Complexity | 793.3943 |
Chemical Identifiers
| CAS Number | 863448-05-9 |
|---|---|
| SMILES | CC(C)(C)N1C2=C(C=N1)C(=O)N(C=N2)CC(=O)NC3CCCCC3 |
Product Overview
ChemDiv3_010982 (CAS 863448-05-9), with molecular formula C17H25N5O2 and molecular weight 331.20 g/mol. IUPAC: 2-(1-tert-butyl-4-oxopyrazolo[5,4-d]pyrimidin-5-yl)-N-cyclohexylacetamide.
Chemical Property Profile of ChemDiv3_010982
Property Insights of ChemDiv3_010982
The XLogP value of 1.7969 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv3_010982. The TPSA of 81.81 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv3_010982. Following Lipinski's Rule of Five, ChemDiv3_010982 has 1 hydrogen bond donor(s) and 4 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 ChemDiv3_010982?
The CAS number of ChemDiv3_010982 is 863448-05-9.
What is the molecular formula of ChemDiv3_010982?
The molecular formula of ChemDiv3_010982 is C17H25N5O2.
What is the molecular weight of ChemDiv3_010982?
The molecular weight of ChemDiv3_010982 is 331.20 g/mol.
Where can I buy ChemDiv3_010982?
You can request a quote for ChemDiv3_010982 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_010982?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_010982 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.