1,4-Phthalazinedione, 2,3-dihydro-5-nitro-
TL;DR: 1,4-Phthalazinedione, 2,3-dihydro-5-nitro- (CAS 3682-15-3) is a chemical compound with molecular formula C8H5N3O4 and molecular weight 207.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-nitro-2,3-dihydrophthalazine-1,4-dione
Also Known As: 3-Nitrophthalhydrazide, 5-nitro-2,3-dihydrophthalazine-1,4-dione, 3-Nitrophthalic Hydrazide, 3-Nitro-phthalhydrazide, 5-nitrophthalhydrazide
| Molecular Formula | C8H5N3O4 |
|---|---|
| Molecular Weight | 207.03 g/mol |
| LogP | 0.1246 |
| Topological Polar Surface Area | 108.86 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 207.028 |
| Heavy Atoms | 15 |
| Complexity | 654.7197 |
Chemical Identifiers
| CAS Number | 3682-15-3 |
|---|---|
| SMILES | C1=CC2=C(C(=C1)[N+](=O)[O-])C(=O)NNC2=O |
Product Overview
1,4-Phthalazinedione, 2,3-dihydro-5-nitro- (CAS 3682-15-3), with molecular formula C8H5N3O4 and molecular weight 207.03 g/mol. IUPAC: 5-nitro-2,3-dihydrophthalazine-1,4-dione.
Chemical Property Profile of 1,4-Phthalazinedione, 2,3-dihydro-5-nitro-
Property Insights of 1,4-Phthalazinedione, 2,3-dihydro-5-nitro-
The XLogP value of 0.1246 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4-Phthalazinedione, 2,3-dihydro-5-nitro-. The TPSA of 108.86 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,4-Phthalazinedione, 2,3-dihydro-5-nitro-. Following Lipinski's Rule of Five, 1,4-Phthalazinedione, 2,3-dihydro-5-nitro- has 2 hydrogen bond donor(s) and 4 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 1,4-Phthalazinedione, 2,3-dihydro-5-nitro-?
The CAS number of 1,4-Phthalazinedione, 2,3-dihydro-5-nitro- is 3682-15-3.
What is the molecular formula of 1,4-Phthalazinedione, 2,3-dihydro-5-nitro-?
The molecular formula of 1,4-Phthalazinedione, 2,3-dihydro-5-nitro- is C8H5N3O4.
What is the molecular weight of 1,4-Phthalazinedione, 2,3-dihydro-5-nitro-?
The molecular weight of 1,4-Phthalazinedione, 2,3-dihydro-5-nitro- is 207.03 g/mol.
Where can I buy 1,4-Phthalazinedione, 2,3-dihydro-5-nitro-?
You can request a quote for 1,4-Phthalazinedione, 2,3-dihydro-5-nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Phthalazinedione, 2,3-dihydro-5-nitro-?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Phthalazinedione, 2,3-dihydro-5-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.