Nerbacadol
TL;DR: Nerbacadol (CAS 99803-72-2) is a chemical compound with molecular formula C10H14N2O2 and molecular weight 194.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-methyl-1,2-oxazol-4-yl)-piperidin-1-ylmethanone
Also Known As: Nerbacadol, Nerbacadolum, Nerbacadol [INN], Nerbacadolum [Latin], Nerbacadolum (Latin)
| Molecular Formula | C10H14N2O2 |
|---|---|
| Molecular Weight | 194.11 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 46.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 194.10553 |
| Heavy Atoms | 14 |
| Complexity | 214.0 |
Chemical Identifiers
| CAS Number | 99803-72-2 |
|---|---|
| SMILES | CC1=C(C=NO1)C(=O)N2CCCCC2 |
| InChIKey | ZWNGSOLJLMBZFZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Nerbacadol (CAS 99803-72-2), with molecular formula C10H14N2O2 and molecular weight 194.11 g/mol. IUPAC: (5-methyl-1,2-oxazol-4-yl)-piperidin-1-ylmethanone.
Chemical Property Profile of Nerbacadol
Property Insights of Nerbacadol
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Nerbacadol. With a topological polar surface area (TPSA) of 46.3 Ų, Nerbacadol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Nerbacadol 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 Nerbacadol?
The CAS number of Nerbacadol is 99803-72-2.
What is the molecular formula of Nerbacadol?
The molecular formula of Nerbacadol is C10H14N2O2.
What is the molecular weight of Nerbacadol?
The molecular weight of Nerbacadol is 194.11 g/mol.
Where can I buy Nerbacadol?
You can request a quote for Nerbacadol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nerbacadol?
Yes, KEHONG BIO provides custom synthesis services for Nerbacadol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.