p-Toluamide, N-antipyrinyl-3-iodo-
TL;DR: p-Toluamide, N-antipyrinyl-3-iodo- (CAS 81217-08-5) is a chemical compound with molecular formula C19H18IN3O2 and molecular weight 447.04 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)-3-iodo-4-methylbenzamide
Also Known As: p-Toluamide, N-antipyrinyl-3-iodo-, N-Antipyrinyl-3-iodo-p-toluamide, n-3-iodo-4-methyl-benzamide, N- -3-iodo-4-methyl-benzamide, N-Antipyrinyl-3-iodo-4-methylbenzamide
| Molecular Formula | C19H18IN3O2 |
|---|---|
| Molecular Weight | 447.04 g/mol |
| LogP | 3.64974 |
| Topological Polar Surface Area | 56.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 447.04437 |
| Heavy Atoms | 25 |
| Complexity | 1003.49896 |
Chemical Identifiers
| CAS Number | 81217-08-5 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)I |
Product Overview
p-Toluamide, N-antipyrinyl-3-iodo- (CAS 81217-08-5), with molecular formula C19H18IN3O2 and molecular weight 447.04 g/mol. IUPAC: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-3-iodo-4-methylbenzamide.
Chemical Property Profile of p-Toluamide, N-antipyrinyl-3-iodo-
Property Insights of p-Toluamide, N-antipyrinyl-3-iodo-
The XLogP value of 3.64974 indicates that p-Toluamide, N-antipyrinyl-3-iodo- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.03 Ų, p-Toluamide, N-antipyrinyl-3-iodo- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, p-Toluamide, N-antipyrinyl-3-iodo- has 1 hydrogen bond donor(s) and 2 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 p-Toluamide, N-antipyrinyl-3-iodo-?
The CAS number of p-Toluamide, N-antipyrinyl-3-iodo- is 81217-08-5.
What is the molecular formula of p-Toluamide, N-antipyrinyl-3-iodo-?
The molecular formula of p-Toluamide, N-antipyrinyl-3-iodo- is C19H18IN3O2.
What is the molecular weight of p-Toluamide, N-antipyrinyl-3-iodo-?
The molecular weight of p-Toluamide, N-antipyrinyl-3-iodo- is 447.04 g/mol.
Where can I buy p-Toluamide, N-antipyrinyl-3-iodo-?
You can request a quote for p-Toluamide, N-antipyrinyl-3-iodo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for p-Toluamide, N-antipyrinyl-3-iodo-?
Yes, KEHONG BIO provides custom synthesis services for p-Toluamide, N-antipyrinyl-3-iodo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.