N-(benzylideneamino)-3-(3-nitrophenyl)-1H-pyrazole-5-carboxamide
TL;DR: N-(benzylideneamino)-3-(3-nitrophenyl)-1H-pyrazole-5-carboxamide (CAS 302918-38-3) is a chemical compound with molecular formula C17H13N5O3 and molecular weight 335.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(benzylideneamino)-3-(3-nitrophenyl)-1H-pyrazole-5-carboxamide
Also Known As: N'-Benzylidene-3-(3-nitrophenyl)-1H-pyrazole-5-carbohydrazide, N-(benzylideneamino)-3-(3-nitrophenyl)-1H-pyrazole-5-carboxamide, N-(benzylideneamino)-5-(3-nitrophenyl)-2H-pyrazole-3-carboxamide
| Molecular Formula | C17H13N5O3 |
|---|---|
| Molecular Weight | 335.10 g/mol |
| LogP | 2.7488 |
| Topological Polar Surface Area | 113.28 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 335.10184 |
| Heavy Atoms | 25 |
| Complexity | 934.22107 |
Chemical Identifiers
| CAS Number | 302918-38-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)C=NNC(=O)C2=CC(=NN2)C3=CC(=CC=C3)[N+](=O)[O-] |
Product Overview
N-(benzylideneamino)-3-(3-nitrophenyl)-1H-pyrazole-5-carboxamide (CAS 302918-38-3), with molecular formula C17H13N5O3 and molecular weight 335.10 g/mol. IUPAC: N-(benzylideneamino)-3-(3-nitrophenyl)-1H-pyrazole-5-carboxamide.
Chemical Property Profile of N-(benzylideneamino)-3-(3-nitrophenyl)-1H-pyrazole-5-carboxamide
Property Insights of N-(benzylideneamino)-3-(3-nitrophenyl)-1H-pyrazole-5-carboxamide
The XLogP value of 2.7488 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(benzylideneamino)-3-(3-nitrophenyl)-1H-pyrazole-5-carboxamide. The TPSA of 113.28 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(benzylideneamino)-3-(3-nitrophenyl)-1H-pyrazole-5-carboxamide. Following Lipinski's Rule of Five, N-(benzylideneamino)-3-(3-nitrophenyl)-1H-pyrazole-5-carboxamide has 2 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 N-(benzylideneamino)-3-(3-nitrophenyl)-1H-pyrazole-5-carboxamide?
The CAS number of N-(benzylideneamino)-3-(3-nitrophenyl)-1H-pyrazole-5-carboxamide is 302918-38-3.
What is the molecular formula of N-(benzylideneamino)-3-(3-nitrophenyl)-1H-pyrazole-5-carboxamide?
The molecular formula of N-(benzylideneamino)-3-(3-nitrophenyl)-1H-pyrazole-5-carboxamide is C17H13N5O3.
What is the molecular weight of N-(benzylideneamino)-3-(3-nitrophenyl)-1H-pyrazole-5-carboxamide?
The molecular weight of N-(benzylideneamino)-3-(3-nitrophenyl)-1H-pyrazole-5-carboxamide is 335.10 g/mol.
Where can I buy N-(benzylideneamino)-3-(3-nitrophenyl)-1H-pyrazole-5-carboxamide?
You can request a quote for N-(benzylideneamino)-3-(3-nitrophenyl)-1H-pyrazole-5-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(benzylideneamino)-3-(3-nitrophenyl)-1H-pyrazole-5-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(benzylideneamino)-3-(3-nitrophenyl)-1H-pyrazole-5-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.