3-bromo-N'-(4-nitrobenzoyl)-2-oxo-2H-pyran-5-carbohydrazide
TL;DR: 3-bromo-N'-(4-nitrobenzoyl)-2-oxo-2H-pyran-5-carbohydrazide (CAS 836632-09-8) is a chemical compound with molecular formula C13H8BrN3O6 and molecular weight 380.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-N'-(4-nitrobenzoyl)-6-oxopyran-3-carbohydrazide
Also Known As: 3-bromo-N'-(4-nitrobenzoyl)-2-oxo-2H-pyran-5-carbohydrazide, 5-bromo-N'-(4-nitrobenzoyl)-6-oxopyran-3-carbohydrazide, 3-bromo-N'-[(4-nitrophenyl)carbonyl]-2-oxo-2H-pyran-5-carbohydrazide
| Molecular Formula | C13H8BrN3O6 |
|---|---|
| Molecular Weight | 380.96 g/mol |
| LogP | 1.3853 |
| Topological Polar Surface Area | 131.55 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 380.95966 |
| Heavy Atoms | 23 |
| Complexity | 830.34863 |
Chemical Identifiers
| CAS Number | 836632-09-8 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)NNC(=O)C2=COC(=O)C(=C2)Br)[N+](=O)[O-] |
Product Overview
3-bromo-N'-(4-nitrobenzoyl)-2-oxo-2H-pyran-5-carbohydrazide (CAS 836632-09-8), with molecular formula C13H8BrN3O6 and molecular weight 380.96 g/mol. IUPAC: 5-bromo-N'-(4-nitrobenzoyl)-6-oxopyran-3-carbohydrazide.
Chemical Property Profile of 3-bromo-N'-(4-nitrobenzoyl)-2-oxo-2H-pyran-5-carbohydrazide
Property Insights of 3-bromo-N'-(4-nitrobenzoyl)-2-oxo-2H-pyran-5-carbohydrazide
The XLogP value of 1.3853 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-bromo-N'-(4-nitrobenzoyl)-2-oxo-2H-pyran-5-carbohydrazide. The TPSA of 131.55 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-bromo-N'-(4-nitrobenzoyl)-2-oxo-2H-pyran-5-carbohydrazide. Following Lipinski's Rule of Five, 3-bromo-N'-(4-nitrobenzoyl)-2-oxo-2H-pyran-5-carbohydrazide has 2 hydrogen bond donor(s) and 6 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 3-bromo-N'-(4-nitrobenzoyl)-2-oxo-2H-pyran-5-carbohydrazide?
The CAS number of 3-bromo-N'-(4-nitrobenzoyl)-2-oxo-2H-pyran-5-carbohydrazide is 836632-09-8.
What is the molecular formula of 3-bromo-N'-(4-nitrobenzoyl)-2-oxo-2H-pyran-5-carbohydrazide?
The molecular formula of 3-bromo-N'-(4-nitrobenzoyl)-2-oxo-2H-pyran-5-carbohydrazide is C13H8BrN3O6.
What is the molecular weight of 3-bromo-N'-(4-nitrobenzoyl)-2-oxo-2H-pyran-5-carbohydrazide?
The molecular weight of 3-bromo-N'-(4-nitrobenzoyl)-2-oxo-2H-pyran-5-carbohydrazide is 380.96 g/mol.
Where can I buy 3-bromo-N'-(4-nitrobenzoyl)-2-oxo-2H-pyran-5-carbohydrazide?
You can request a quote for 3-bromo-N'-(4-nitrobenzoyl)-2-oxo-2H-pyran-5-carbohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-bromo-N'-(4-nitrobenzoyl)-2-oxo-2H-pyran-5-carbohydrazide?
Yes, KEHONG BIO provides custom synthesis services for 3-bromo-N'-(4-nitrobenzoyl)-2-oxo-2H-pyran-5-carbohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.