(5-Anilino-3-methylpyrazol-1-yl)-(4-nitrophenyl)methanone
TL;DR: (5-Anilino-3-methylpyrazol-1-yl)-(4-nitrophenyl)methanone (CAS 64808-41-9) is a chemical compound with molecular formula C17H14N4O3 and molecular weight 322.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-anilino-3-methylpyrazol-1-yl)-(4-nitrophenyl)methanone
Also Known As: BIM-0009267.P001, 3-methyl-1-(4-nitrobenzoyl)-N-phenyl-1H-pyrazol-5-amine, AB00686126-01, (5-anilino-3-methylpyrazol-1-yl)-(4-nitrophenyl)methanone, F1541-0057
| Molecular Formula | C17H14N4O3 |
|---|---|
| Molecular Weight | 322.11 g/mol |
| LogP | 3.53182 |
| Topological Polar Surface Area | 90.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 322.1066 |
| Heavy Atoms | 24 |
| Complexity | 885.9589 |
Chemical Identifiers
| CAS Number | 64808-41-9 |
|---|---|
| SMILES | CC1=NN(C(=C1)NC2=CC=CC=C2)C(=O)C3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
(5-Anilino-3-methylpyrazol-1-yl)-(4-nitrophenyl)methanone (CAS 64808-41-9), with molecular formula C17H14N4O3 and molecular weight 322.11 g/mol. IUPAC: (5-anilino-3-methylpyrazol-1-yl)-(4-nitrophenyl)methanone.
Chemical Property Profile of (5-Anilino-3-methylpyrazol-1-yl)-(4-nitrophenyl)methanone
Property Insights of (5-Anilino-3-methylpyrazol-1-yl)-(4-nitrophenyl)methanone
The XLogP value of 3.53182 indicates that (5-Anilino-3-methylpyrazol-1-yl)-(4-nitrophenyl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.06 Ų falls within the moderate polarity range, balancing permeability and solubility for (5-Anilino-3-methylpyrazol-1-yl)-(4-nitrophenyl)methanone. Following Lipinski's Rule of Five, (5-Anilino-3-methylpyrazol-1-yl)-(4-nitrophenyl)methanone has 1 hydrogen bond donor(s) and 5 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 (5-Anilino-3-methylpyrazol-1-yl)-(4-nitrophenyl)methanone?
The CAS number of (5-Anilino-3-methylpyrazol-1-yl)-(4-nitrophenyl)methanone is 64808-41-9.
What is the molecular formula of (5-Anilino-3-methylpyrazol-1-yl)-(4-nitrophenyl)methanone?
The molecular formula of (5-Anilino-3-methylpyrazol-1-yl)-(4-nitrophenyl)methanone is C17H14N4O3.
What is the molecular weight of (5-Anilino-3-methylpyrazol-1-yl)-(4-nitrophenyl)methanone?
The molecular weight of (5-Anilino-3-methylpyrazol-1-yl)-(4-nitrophenyl)methanone is 322.11 g/mol.
Where can I buy (5-Anilino-3-methylpyrazol-1-yl)-(4-nitrophenyl)methanone?
You can request a quote for (5-Anilino-3-methylpyrazol-1-yl)-(4-nitrophenyl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5-Anilino-3-methylpyrazol-1-yl)-(4-nitrophenyl)methanone?
Yes, KEHONG BIO provides custom synthesis services for (5-Anilino-3-methylpyrazol-1-yl)-(4-nitrophenyl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.