(4aR,8aS)-7-(4-methylpent-3-en-1-yl)-2-phenyl-2,3,4a,5,8,8a-hexahydrophthalazine-1,4-dione
TL;DR: (4aR,8aS)-7-(4-methylpent-3-en-1-yl)-2-phenyl-2,3,4a,5,8,8a-hexahydrophthalazine-1,4-dione (CAS 1212318-08-5) is a chemical compound with molecular formula C20H24N2O2 and molecular weight 324.18378 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4aS,8aR)-6-(4-methylpent-3-enyl)-3-phenyl-4a,5,8,8a-tetrahydro-2H-phthalazine-1,4-dione
Also Known As: (4aR,8aS)-7-(4-methylpent-3-en-1-yl)-2-phenyl-2,3,4a,5,8,8a-hexahydrophthalazine-1,4-dione, (4aS,8aR)-6-(4-methylpent-3-enyl)-3-phenyl-4a,5,8,8a-tetrahydro-2H-phthalazine-1,4-dione
Technical Specifications
| Molecular Formula | C20H24N2O2 |
| Molecular Weight | 324.18378 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 49.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 324.18378 Da |
| Heavy Atoms | 24 |
| Complexity | 554.0 |
| SMILES | CC(=CCCC1=CC[C@@H]2[C@H](C1)C(=O)N(NC2=O)C3=CC=CC=C3)C |
| InChIKey | XMGHGZFUAASIJW-MSOLQXFVSA-N |
Chemical Property Profile of (4aR,8aS)-7-(4-methylpent-3-en-1-yl)-2-phenyl-2,3,4a,5,8,8a-hexahydrophthalazine-1,4-dione
Property Insights of (4aR,8aS)-7-(4-methylpent-3-en-1-yl)-2-phenyl-2,3,4a,5,8,8a-hexahydrophthalazine-1,4-dione
The XLogP value of 3.4 indicates that (4aR,8aS)-7-(4-methylpent-3-en-1-yl)-2-phenyl-2,3,4a,5,8,8a-hexahydrophthalazine-1,4-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.4 Ų, (4aR,8aS)-7-(4-methylpent-3-en-1-yl)-2-phenyl-2,3,4a,5,8,8a-hexahydrophthalazine-1,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4aR,8aS)-7-(4-methylpent-3-en-1-yl)-2-phenyl-2,3,4a,5,8,8a-hexahydrophthalazine-1,4-dione has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (4aR,8aS)-7-(4-methylpent-3-en-1-yl)-2-phenyl-2,3,4a,5,8,8a-hexahydrophthalazine-1,4-dione?
The CAS number of (4aR,8aS)-7-(4-methylpent-3-en-1-yl)-2-phenyl-2,3,4a,5,8,8a-hexahydrophthalazine-1,4-dione is 1212318-08-5.
What is the molecular formula of (4aR,8aS)-7-(4-methylpent-3-en-1-yl)-2-phenyl-2,3,4a,5,8,8a-hexahydrophthalazine-1,4-dione?
The molecular formula of (4aR,8aS)-7-(4-methylpent-3-en-1-yl)-2-phenyl-2,3,4a,5,8,8a-hexahydrophthalazine-1,4-dione is C20H24N2O2.
What is the molecular weight of (4aR,8aS)-7-(4-methylpent-3-en-1-yl)-2-phenyl-2,3,4a,5,8,8a-hexahydrophthalazine-1,4-dione?
The molecular weight of (4aR,8aS)-7-(4-methylpent-3-en-1-yl)-2-phenyl-2,3,4a,5,8,8a-hexahydrophthalazine-1,4-dione is 324.18378 g/mol.
Where can I buy (4aR,8aS)-7-(4-methylpent-3-en-1-yl)-2-phenyl-2,3,4a,5,8,8a-hexahydrophthalazine-1,4-dione?
You can request a quote for (4aR,8aS)-7-(4-methylpent-3-en-1-yl)-2-phenyl-2,3,4a,5,8,8a-hexahydrophthalazine-1,4-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (4aR,8aS)-7-(4-methylpent-3-en-1-yl)-2-phenyl-2,3,4a,5,8,8a-hexahydrophthalazine-1,4-dione?
Yes, CoreyChem provides custom synthesis services for (4aR,8aS)-7-(4-methylpent-3-en-1-yl)-2-phenyl-2,3,4a,5,8,8a-hexahydrophthalazine-1,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.