1-Methyl-4-(piperidin-1-yl)phthalazine
TL;DR: 1-Methyl-4-(piperidin-1-yl)phthalazine (CAS 333776-14-0) is a chemical compound with molecular formula C14H17N3 and molecular weight 227.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-4-piperidin-1-ylphthalazine
Also Known As: 1-methyl-4-(piperidin-1-yl)phthalazine, 1-methyl-4-piperidin-1-ylphthalazine
| Molecular Formula | C14H17N3 |
|---|---|
| Molecular Weight | 227.14 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 29.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 227.14224 |
| Heavy Atoms | 17 |
| Complexity | 250.0 |
Chemical Identifiers
| CAS Number | 333776-14-0 |
|---|---|
| SMILES | CC1=NN=C(C2=CC=CC=C12)N3CCCCC3 |
| InChIKey | HBEIWQYSNGCUDK-UHFFFAOYSA-N |
Product Overview
1-Methyl-4-(piperidin-1-yl)phthalazine (CAS 333776-14-0), with molecular formula C14H17N3 and molecular weight 227.14 g/mol. IUPAC: 1-methyl-4-piperidin-1-ylphthalazine.
Chemical Property Profile of 1-Methyl-4-(piperidin-1-yl)phthalazine
Property Insights of 1-Methyl-4-(piperidin-1-yl)phthalazine
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methyl-4-(piperidin-1-yl)phthalazine. With a topological polar surface area (TPSA) of 29.0 Ų, 1-Methyl-4-(piperidin-1-yl)phthalazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methyl-4-(piperidin-1-yl)phthalazine has 0 hydrogen bond donor(s) and 3 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-Methyl-4-(piperidin-1-yl)phthalazine?
The CAS number of 1-Methyl-4-(piperidin-1-yl)phthalazine is 333776-14-0.
What is the molecular formula of 1-Methyl-4-(piperidin-1-yl)phthalazine?
The molecular formula of 1-Methyl-4-(piperidin-1-yl)phthalazine is C14H17N3.
What is the molecular weight of 1-Methyl-4-(piperidin-1-yl)phthalazine?
The molecular weight of 1-Methyl-4-(piperidin-1-yl)phthalazine is 227.14 g/mol.
Where can I buy 1-Methyl-4-(piperidin-1-yl)phthalazine?
You can request a quote for 1-Methyl-4-(piperidin-1-yl)phthalazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methyl-4-(piperidin-1-yl)phthalazine?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-4-(piperidin-1-yl)phthalazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.