Antipyrine, 4-benzamido-
TL;DR: Antipyrine, 4-benzamido- (CAS 5702-68-1) is a chemical compound with molecular formula C18H17N3O2 and molecular weight 307.13 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)benzamide
Also Known As: 4-Benzamidoantipyrine, N-Antipyrinylbenzamide, Antipyrine, 4-benzamido-, ChemDiv3_000032, BENZAMIDE, N-ANTIPYRINYL-
| Molecular Formula | C18H17N3O2 |
|---|---|
| Molecular Weight | 307.13 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 52.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 307.13208 |
| Heavy Atoms | 23 |
| Complexity | 502.0 |
Chemical Identifiers
| CAS Number | 5702-68-1 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C3=CC=CC=C3 |
| InChIKey | TWAXSNQMTXARTQ-UHFFFAOYSA-N |
Product Overview
Antipyrine, 4-benzamido- (CAS 5702-68-1), with molecular formula C18H17N3O2 and molecular weight 307.13 g/mol. IUPAC: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)benzamide.
Chemical Property Profile of Antipyrine, 4-benzamido-
Property Insights of Antipyrine, 4-benzamido-
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Antipyrine, 4-benzamido-. With a topological polar surface area (TPSA) of 52.7 Ų, Antipyrine, 4-benzamido- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Antipyrine, 4-benzamido- 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 Antipyrine, 4-benzamido-?
The CAS number of Antipyrine, 4-benzamido- is 5702-68-1.
What is the molecular formula of Antipyrine, 4-benzamido-?
The molecular formula of Antipyrine, 4-benzamido- is C18H17N3O2.
What is the molecular weight of Antipyrine, 4-benzamido-?
The molecular weight of Antipyrine, 4-benzamido- is 307.13 g/mol.
Where can I buy Antipyrine, 4-benzamido-?
You can request a quote for Antipyrine, 4-benzamido- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Antipyrine, 4-benzamido-?
Yes, KEHONG BIO provides custom synthesis services for Antipyrine, 4-benzamido- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.