Nitrosoantipyrine
TL;DR: Nitrosoantipyrine (CAS 885-11-0) is a chemical compound with molecular formula C11H11N3O2 and molecular weight 217.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,5-dimethyl-4-nitroso-2-phenylpyrazol-3-one
Also Known As: 4-Nitrosoantipyrine, Nitrosoantipyrine, 4-Nitrosoantipyrin, Nitrosoantipyrin, Nitroso Antipyrine
| Molecular Formula | C11H11N3O2 |
|---|---|
| Molecular Weight | 217.09 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 53.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 217.08513 |
| Heavy Atoms | 16 |
| Complexity | 345.0 |
Chemical Identifiers
| CAS Number | 885-11-0 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=O |
| InChIKey | IEODZSWSXNQPQL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Nitrosoantipyrine (CAS 885-11-0), with molecular formula C11H11N3O2 and molecular weight 217.09 g/mol. IUPAC: 1,5-dimethyl-4-nitroso-2-phenylpyrazol-3-one.
Chemical Property Profile of Nitrosoantipyrine
Property Insights of Nitrosoantipyrine
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Nitrosoantipyrine. With a topological polar surface area (TPSA) of 53.0 Ų, Nitrosoantipyrine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Nitrosoantipyrine has 0 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 Nitrosoantipyrine?
The CAS number of Nitrosoantipyrine is 885-11-0.
What is the molecular formula of Nitrosoantipyrine?
The molecular formula of Nitrosoantipyrine is C11H11N3O2.
What is the molecular weight of Nitrosoantipyrine?
The molecular weight of Nitrosoantipyrine is 217.09 g/mol.
Where can I buy Nitrosoantipyrine?
You can request a quote for Nitrosoantipyrine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nitrosoantipyrine?
Yes, KEHONG BIO provides custom synthesis services for Nitrosoantipyrine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.