![4-(4-{[3-(dimethylamino)propyl]amino}-3-nitrophenyl)phthalazin-1(2H)-one structure](/static/products/577/577982-62-8.png)
4-(4-{[3-(dimethylamino)propyl]amino}-3-nitrophenyl)phthalazin-1(2H)-one
TL;DR: 4-(4-{[3-(dimethylamino)propyl]amino}-3-nitrophenyl)phthalazin-1(2H)-one (CAS 577982-62-8) is a chemical compound with molecular formula C19H21N5O3 and molecular weight 367.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-[3-(dimethylamino)propylamino]-3-nitrophenyl]-2H-phthalazin-1-one
Also Known As: BAS 06635389, 4-(4-{[3-(dimethylamino)propyl]amino}-3-nitrophenyl)phthalazin-1(2H)-one, 4-[4-(3-Dimethylamino-propylamino)-3-nitro-phenyl]-2H-phthalazin-1-one, 4-(4-((3-(dimethylamino)propyl)amino)-3-nitrophenyl)phthalazin-1(2H)-one, 4-(4-{[3-(dimethylamino)propyl]amino}-3-nitrophenyl)-1(2H)-phthalazinone
| Molecular Formula | C19H21N5O3 |
|---|---|
| Molecular Weight | 367.16 g/mol |
| LogP | 2.8619 |
| Topological Polar Surface Area | 104.16 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 367.16443 |
| Heavy Atoms | 27 |
| Complexity | 1029.274 |
Chemical Identifiers
| CAS Number | 577982-62-8 |
|---|---|
| SMILES | CN(C)CCCNC1=C(C=C(C=C1)C2=NNC(=O)C3=CC=CC=C32)[N+](=O)[O-] |
Product Overview
4-(4-{[3-(dimethylamino)propyl]amino}-3-nitrophenyl)phthalazin-1(2H)-one (CAS 577982-62-8), with molecular formula C19H21N5O3 and molecular weight 367.16 g/mol. IUPAC: 4-[4-[3-(dimethylamino)propylamino]-3-nitrophenyl]-2H-phthalazin-1-one.
Chemical Property Profile of 4-(4-{[3-(dimethylamino)propyl]amino}-3-nitrophenyl)phthalazin-1(2H)-one
Property Insights of 4-(4-{[3-(dimethylamino)propyl]amino}-3-nitrophenyl)phthalazin-1(2H)-one
The XLogP value of 2.8619 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(4-{[3-(dimethylamino)propyl]amino}-3-nitrophenyl)phthalazin-1(2H)-one. The TPSA of 104.16 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-{[3-(dimethylamino)propyl]amino}-3-nitrophenyl)phthalazin-1(2H)-one. Following Lipinski's Rule of Five, 4-(4-{[3-(dimethylamino)propyl]amino}-3-nitrophenyl)phthalazin-1(2H)-one 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 4-(4-{[3-(dimethylamino)propyl]amino}-3-nitrophenyl)phthalazin-1(2H)-one?
The CAS number of 4-(4-{[3-(dimethylamino)propyl]amino}-3-nitrophenyl)phthalazin-1(2H)-one is 577982-62-8.
What is the molecular formula of 4-(4-{[3-(dimethylamino)propyl]amino}-3-nitrophenyl)phthalazin-1(2H)-one?
The molecular formula of 4-(4-{[3-(dimethylamino)propyl]amino}-3-nitrophenyl)phthalazin-1(2H)-one is C19H21N5O3.
What is the molecular weight of 4-(4-{[3-(dimethylamino)propyl]amino}-3-nitrophenyl)phthalazin-1(2H)-one?
The molecular weight of 4-(4-{[3-(dimethylamino)propyl]amino}-3-nitrophenyl)phthalazin-1(2H)-one is 367.16 g/mol.
Where can I buy 4-(4-{[3-(dimethylamino)propyl]amino}-3-nitrophenyl)phthalazin-1(2H)-one?
You can request a quote for 4-(4-{[3-(dimethylamino)propyl]amino}-3-nitrophenyl)phthalazin-1(2H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-{[3-(dimethylamino)propyl]amino}-3-nitrophenyl)phthalazin-1(2H)-one?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-{[3-(dimethylamino)propyl]amino}-3-nitrophenyl)phthalazin-1(2H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.