Benzaldehyde, 4-nitro-, (3,4-dihydro-4-oxo-1-phthalazinyl)methylhydrazone
TL;DR: Benzaldehyde, 4-nitro-, (3,4-dihydro-4-oxo-1-phthalazinyl)methylhydrazone (CAS 64640-76-2) is a chemical compound with molecular formula C16H13N5O3 and molecular weight 323.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[(2E)-2-[(4-nitrophenyl)methylidene]hydrazinyl]methyl]-2H-phthalazin-1-one
Also Known As: 4-Nitrobenzaldehyde (3,4-dihydro-4-oxo-1-phthalazinyl)methylhydrazone, BENZALDEHYDE, 4-NITRO-, (3,4-DIHYDRO-4-OXO-1-PHTHALAZINYL)METHYLHYDRAZONE, RefChem:1077858, BRN 0897185
| Molecular Formula | C16H13N5O3 |
|---|---|
| Molecular Weight | 323.10 g/mol |
| LogP | 1.955 |
| Topological Polar Surface Area | 113.28 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 323.10184 |
| Heavy Atoms | 24 |
| Complexity | 963.3589 |
Chemical Identifiers
| CAS Number | 64640-76-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=NNC2=O)CN/N=C/C3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
Benzaldehyde, 4-nitro-, (3,4-dihydro-4-oxo-1-phthalazinyl)methylhydrazone (CAS 64640-76-2), with molecular formula C16H13N5O3 and molecular weight 323.10 g/mol. IUPAC: 4-[[(2E)-2-[(4-nitrophenyl)methylidene]hydrazinyl]methyl]-2H-phthalazin-1-one.
Chemical Property Profile of Benzaldehyde, 4-nitro-, (3,4-dihydro-4-oxo-1-phthalazinyl)methylhydrazone
Property Insights of Benzaldehyde, 4-nitro-, (3,4-dihydro-4-oxo-1-phthalazinyl)methylhydrazone
The XLogP value of 1.955 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzaldehyde, 4-nitro-, (3,4-dihydro-4-oxo-1-phthalazinyl)methylhydrazone. The TPSA of 113.28 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzaldehyde, 4-nitro-, (3,4-dihydro-4-oxo-1-phthalazinyl)methylhydrazone. Following Lipinski's Rule of Five, Benzaldehyde, 4-nitro-, (3,4-dihydro-4-oxo-1-phthalazinyl)methylhydrazone 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 Benzaldehyde, 4-nitro-, (3,4-dihydro-4-oxo-1-phthalazinyl)methylhydrazone?
The CAS number of Benzaldehyde, 4-nitro-, (3,4-dihydro-4-oxo-1-phthalazinyl)methylhydrazone is 64640-76-2.
What is the molecular formula of Benzaldehyde, 4-nitro-, (3,4-dihydro-4-oxo-1-phthalazinyl)methylhydrazone?
The molecular formula of Benzaldehyde, 4-nitro-, (3,4-dihydro-4-oxo-1-phthalazinyl)methylhydrazone is C16H13N5O3.
What is the molecular weight of Benzaldehyde, 4-nitro-, (3,4-dihydro-4-oxo-1-phthalazinyl)methylhydrazone?
The molecular weight of Benzaldehyde, 4-nitro-, (3,4-dihydro-4-oxo-1-phthalazinyl)methylhydrazone is 323.10 g/mol.
Where can I buy Benzaldehyde, 4-nitro-, (3,4-dihydro-4-oxo-1-phthalazinyl)methylhydrazone?
You can request a quote for Benzaldehyde, 4-nitro-, (3,4-dihydro-4-oxo-1-phthalazinyl)methylhydrazone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzaldehyde, 4-nitro-, (3,4-dihydro-4-oxo-1-phthalazinyl)methylhydrazone?
Yes, KEHONG BIO provides custom synthesis services for Benzaldehyde, 4-nitro-, (3,4-dihydro-4-oxo-1-phthalazinyl)methylhydrazone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.