1,2,4-Triazolo(3,4-a)phthalazine, 3-(4-chloro-3-nitrophenyl)-6-(1-pyrrolidinyl)-
TL;DR: 1,2,4-Triazolo(3,4-a)phthalazine, 3-(4-chloro-3-nitrophenyl)-6-(1-pyrrolidinyl)- (CAS 87540-12-3) is a chemical compound with molecular formula C19H15ClN6O2 and molecular weight 394.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-chloro-3-nitrophenyl)-6-pyrrolidin-1-yl-[1,2,4]triazolo[3,4-a]phthalazine
Also Known As: 1,2,4-Triazolo(3,4-a)phthalazine, 3-(4-chloro-3-nitrophenyl)-6-(1-pyrrolidinyl)-, 3-(4-Chloro-3-nitrophenyl)-6-(1-pyrrolidinyl)-1,2,4-triazolo(3,4-a)phthalazine, 3-(4-Chloro-3-nitrophenyl)-6-(pyrrolidin-1-yl)-[1,2,4]triazolo[3,4-a]phthalazine, 3-(4-CHLORO-3-NITROPHENYL)-6-(PYRROLIDIN-1-YL)-1,2,4-TRIAZOLO[3,4-A]PHTHALAZINE, 3-(4-Chloro-3-nitrophenyl)-6-(pyrrolidin-1-yl)[1,2,4]triazolo[3,4-a]phthalazine
| Molecular Formula | C19H15ClN6O2 |
|---|---|
| Molecular Weight | 394.09 g/mol |
| LogP | 4.1063 |
| Topological Polar Surface Area | 89.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 394.0945 |
| Heavy Atoms | 28 |
| Complexity | 1232.0348 |
Chemical Identifiers
| CAS Number | 87540-12-3 |
|---|---|
| SMILES | C1CCN(C1)C2=NN3C(=NN=C3C4=CC=CC=C42)C5=CC(=C(C=C5)Cl)[N+](=O)[O-] |
Product Overview
1,2,4-Triazolo(3,4-a)phthalazine, 3-(4-chloro-3-nitrophenyl)-6-(1-pyrrolidinyl)- (CAS 87540-12-3), with molecular formula C19H15ClN6O2 and molecular weight 394.09 g/mol. IUPAC: 3-(4-chloro-3-nitrophenyl)-6-pyrrolidin-1-yl-[1,2,4]triazolo[3,4-a]phthalazine.
Chemical Property Profile of 1,2,4-Triazolo(3,4-a)phthalazine, 3-(4-chloro-3-nitrophenyl)-6-(1-pyrrolidinyl)-
Property Insights of 1,2,4-Triazolo(3,4-a)phthalazine, 3-(4-chloro-3-nitrophenyl)-6-(1-pyrrolidinyl)-
The XLogP value of 4.1063 indicates that 1,2,4-Triazolo(3,4-a)phthalazine, 3-(4-chloro-3-nitrophenyl)-6-(1-pyrrolidinyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.46 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2,4-Triazolo(3,4-a)phthalazine, 3-(4-chloro-3-nitrophenyl)-6-(1-pyrrolidinyl)-. Following Lipinski's Rule of Five, 1,2,4-Triazolo(3,4-a)phthalazine, 3-(4-chloro-3-nitrophenyl)-6-(1-pyrrolidinyl)- has 0 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 1,2,4-Triazolo(3,4-a)phthalazine, 3-(4-chloro-3-nitrophenyl)-6-(1-pyrrolidinyl)-?
The CAS number of 1,2,4-Triazolo(3,4-a)phthalazine, 3-(4-chloro-3-nitrophenyl)-6-(1-pyrrolidinyl)- is 87540-12-3.
What is the molecular formula of 1,2,4-Triazolo(3,4-a)phthalazine, 3-(4-chloro-3-nitrophenyl)-6-(1-pyrrolidinyl)-?
The molecular formula of 1,2,4-Triazolo(3,4-a)phthalazine, 3-(4-chloro-3-nitrophenyl)-6-(1-pyrrolidinyl)- is C19H15ClN6O2.
What is the molecular weight of 1,2,4-Triazolo(3,4-a)phthalazine, 3-(4-chloro-3-nitrophenyl)-6-(1-pyrrolidinyl)-?
The molecular weight of 1,2,4-Triazolo(3,4-a)phthalazine, 3-(4-chloro-3-nitrophenyl)-6-(1-pyrrolidinyl)- is 394.09 g/mol.
Where can I buy 1,2,4-Triazolo(3,4-a)phthalazine, 3-(4-chloro-3-nitrophenyl)-6-(1-pyrrolidinyl)-?
You can request a quote for 1,2,4-Triazolo(3,4-a)phthalazine, 3-(4-chloro-3-nitrophenyl)-6-(1-pyrrolidinyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,4-Triazolo(3,4-a)phthalazine, 3-(4-chloro-3-nitrophenyl)-6-(1-pyrrolidinyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1,2,4-Triazolo(3,4-a)phthalazine, 3-(4-chloro-3-nitrophenyl)-6-(1-pyrrolidinyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.