4-(Formylamino)antipyrine
TL;DR: 4-(Formylamino)antipyrine (CAS 1672-58-8) is a chemical compound with molecular formula C12H13N3O2 and molecular weight 231.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)formamide
Also Known As: 4-Formylaminoantipyrine, 4-Formylamino Antipyrine, 4-Formamidoantipyrine, 4-Formylantipyrine, 4-(Formylamino)antipyrine
| Molecular Formula | C12H13N3O2 |
|---|---|
| Molecular Weight | 231.10 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 52.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 231.10077 |
| Heavy Atoms | 17 |
| Complexity | 359.0 |
Chemical Identifiers
| CAS Number | 1672-58-8 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC=O |
| InChIKey | WSJBSKRPKADYRQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-(Formylamino)antipyrine (CAS 1672-58-8), with molecular formula C12H13N3O2 and molecular weight 231.10 g/mol. IUPAC: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)formamide.
Chemical Property Profile of 4-(Formylamino)antipyrine
Property Insights of 4-(Formylamino)antipyrine
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Formylamino)antipyrine. With a topological polar surface area (TPSA) of 52.7 Ų, 4-(Formylamino)antipyrine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Formylamino)antipyrine has 1 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 4-(Formylamino)antipyrine?
The CAS number of 4-(Formylamino)antipyrine is 1672-58-8.
What is the molecular formula of 4-(Formylamino)antipyrine?
The molecular formula of 4-(Formylamino)antipyrine is C12H13N3O2.
What is the molecular weight of 4-(Formylamino)antipyrine?
The molecular weight of 4-(Formylamino)antipyrine is 231.10 g/mol.
Where can I buy 4-(Formylamino)antipyrine?
You can request a quote for 4-(Formylamino)antipyrine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Formylamino)antipyrine?
Yes, KEHONG BIO provides custom synthesis services for 4-(Formylamino)antipyrine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.