N-安替比林基-对碘苯甲酰胺
TL;DR: N-安替比林基-对碘苯甲酰胺 (CAS 81217-07-4) is a chemical compound with molecular formula C18H16IN3O2 and molecular weight 433.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-安替比林基-对碘苯甲酰胺
N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-4-iodobenzamide
Also Known As: N-Antipyrinyl-p-iodobenzamide, BENZAMIDE, N-ANTIPYRINYL-p-IODO-, N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-4-iodobenzamide, N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-4-iodobenzamide, BRN 5115208
| Molecular Formula | C18H16IN3O2 |
|---|---|
| Molecular Weight | 433.03 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 52.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 433.02872 |
| Heavy Atoms | 24 |
| Complexity | 534.0 |
Chemical Identifiers
| CAS Number | 81217-07-4 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)I |
| InChIKey | GZBALIAMXXEKSK-UHFFFAOYSA-N |
Product Overview
N-安替比林基-对碘苯甲酰胺 (CAS 81217-07-4), with molecular formula C18H16IN3O2 and molecular weight 433.03 g/mol. IUPAC: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-4-iodobenzamide.
Chemical Property Profile of N-安替比林基-对碘苯甲酰胺
Property Insights of N-安替比林基-对碘苯甲酰胺
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-安替比林基-对碘苯甲酰胺. With a topological polar surface area (TPSA) of 52.7 Ų, N-安替比林基-对碘苯甲酰胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-安替比林基-对碘苯甲酰胺 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 N-安替比林基-对碘苯甲酰胺?
The CAS number of N-安替比林基-对碘苯甲酰胺 is 81217-07-4.
What is the molecular formula of N-安替比林基-对碘苯甲酰胺?
The molecular formula of N-安替比林基-对碘苯甲酰胺 is C18H16IN3O2.
What is the molecular weight of N-安替比林基-对碘苯甲酰胺?
The molecular weight of N-安替比林基-对碘苯甲酰胺 is 433.03 g/mol.
Where can I buy N-安替比林基-对碘苯甲酰胺?
You can request a quote for N-安替比林基-对碘苯甲酰胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-安替比林基-对碘苯甲酰胺?
Yes, KEHONG BIO provides custom synthesis services for N-安替比林基-对碘苯甲酰胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.