8a-methyl-6-(4-methylpent-3-enyl)-3,4a,5,8-tetrahydro-2H-phthalazine-1,4-dione
TL;DR: 8a-methyl-6-(4-methylpent-3-enyl)-3,4a,5,8-tetrahydro-2H-phthalazine-1,4-dione (CAS 333344-72-2) is a chemical compound with molecular formula C15H22N2O2 and molecular weight 262.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8a-methyl-6-(4-methylpent-3-enyl)-3,4a,5,8-tetrahydro-2H-phthalazine-1,4-dione
Also Known As: BIM-0029952.P001, AB00095427-01, 8a-methyl-6-(4-methylpent-3-enyl)-3,4a,5,8-tetrahydro-2H-phthalazine-1,4-dione, 4-hydroxy-4a-methyl-7-(4-methylpent-3-en-1-yl)-4a,5,8,8a-tetrahydrophthalazin-1(2H)-one, 4a-methyl-7-(4-methyl-3-pentenyl)-2,3,4a,5,8,8a-hexahydro-1,4-phthalazinedione
| Molecular Formula | C15H22N2O2 |
|---|---|
| Molecular Weight | 262.17 g/mol |
| LogP | 2.2365 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 262.16812 |
| Heavy Atoms | 19 |
| Complexity | 460.76602 |
Chemical Identifiers
| CAS Number | 333344-72-2 |
|---|---|
| SMILES | CC(=CCCC1=CCC2(C(C1)C(=O)NNC2=O)C)C |
Product Overview
8a-methyl-6-(4-methylpent-3-enyl)-3,4a,5,8-tetrahydro-2H-phthalazine-1,4-dione (CAS 333344-72-2), with molecular formula C15H22N2O2 and molecular weight 262.17 g/mol. IUPAC: 8a-methyl-6-(4-methylpent-3-enyl)-3,4a,5,8-tetrahydro-2H-phthalazine-1,4-dione.
Chemical Property Profile of 8a-methyl-6-(4-methylpent-3-enyl)-3,4a,5,8-tetrahydro-2H-phthalazine-1,4-dione
Property Insights of 8a-methyl-6-(4-methylpent-3-enyl)-3,4a,5,8-tetrahydro-2H-phthalazine-1,4-dione
The XLogP value of 2.2365 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8a-methyl-6-(4-methylpent-3-enyl)-3,4a,5,8-tetrahydro-2H-phthalazine-1,4-dione. With a topological polar surface area (TPSA) of 58.2 Ų, 8a-methyl-6-(4-methylpent-3-enyl)-3,4a,5,8-tetrahydro-2H-phthalazine-1,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8a-methyl-6-(4-methylpent-3-enyl)-3,4a,5,8-tetrahydro-2H-phthalazine-1,4-dione has 2 hydrogen bond donor(s) and 2 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 8a-methyl-6-(4-methylpent-3-enyl)-3,4a,5,8-tetrahydro-2H-phthalazine-1,4-dione?
The CAS number of 8a-methyl-6-(4-methylpent-3-enyl)-3,4a,5,8-tetrahydro-2H-phthalazine-1,4-dione is 333344-72-2.
What is the molecular formula of 8a-methyl-6-(4-methylpent-3-enyl)-3,4a,5,8-tetrahydro-2H-phthalazine-1,4-dione?
The molecular formula of 8a-methyl-6-(4-methylpent-3-enyl)-3,4a,5,8-tetrahydro-2H-phthalazine-1,4-dione is C15H22N2O2.
What is the molecular weight of 8a-methyl-6-(4-methylpent-3-enyl)-3,4a,5,8-tetrahydro-2H-phthalazine-1,4-dione?
The molecular weight of 8a-methyl-6-(4-methylpent-3-enyl)-3,4a,5,8-tetrahydro-2H-phthalazine-1,4-dione is 262.17 g/mol.
Where can I buy 8a-methyl-6-(4-methylpent-3-enyl)-3,4a,5,8-tetrahydro-2H-phthalazine-1,4-dione?
You can request a quote for 8a-methyl-6-(4-methylpent-3-enyl)-3,4a,5,8-tetrahydro-2H-phthalazine-1,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8a-methyl-6-(4-methylpent-3-enyl)-3,4a,5,8-tetrahydro-2H-phthalazine-1,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 8a-methyl-6-(4-methylpent-3-enyl)-3,4a,5,8-tetrahydro-2H-phthalazine-1,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.