布屈嗪
TL;DR: 布屈嗪 (CAS 36798-79-5) is a chemical compound with molecular formula C14H16N4 and molecular weight 240.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
布屈嗪
N-(4-methylpent-3-en-2-ylideneamino)phthalazin-1-amine
Also Known As: budralazine, Buterazine, Budralazina, Budralazinum, dihydrooxophthalazine
| Molecular Formula | C14H16N4 |
|---|---|
| Molecular Weight | 240.14 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 50.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 240.1375 |
| Heavy Atoms | 18 |
| Complexity | 331.0 |
Chemical Identifiers
| CAS Number | 36798-79-5 |
|---|---|
| SMILES | CC(=CC(=NNC1=NN=CC2=CC=CC=C21)C)C |
| InChIKey | DQGFCLJXYFXXIJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
布屈嗪 (CAS 36798-79-5), with molecular formula C14H16N4 and molecular weight 240.14 g/mol. IUPAC: N-(4-methylpent-3-en-2-ylideneamino)phthalazin-1-amine.
Chemical Property Profile of 布屈嗪
Property Insights of 布屈嗪
The XLogP value of 3.1 indicates that 布屈嗪 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.2 Ų, 布屈嗪 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 布屈嗪 has 1 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 布屈嗪?
The CAS number of 布屈嗪 is 36798-79-5.
What is the molecular formula of 布屈嗪?
The molecular formula of 布屈嗪 is C14H16N4.
What is the molecular weight of 布屈嗪?
The molecular weight of 布屈嗪 is 240.14 g/mol.
Where can I buy 布屈嗪?
You can request a quote for 布屈嗪 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 布屈嗪?
Yes, KEHONG BIO provides custom synthesis services for 布屈嗪 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.