RefChem:276749
TL;DR: RefChem:276749 (CAS 90619-44-6) is a chemical compound with molecular formula C24H37Cl2N3O2 and molecular weight 469.2263 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,8,8-trimethyl-3-[3-[4-(4-methylphenyl)piperazin-1-yl]propyl]-3-azabicyclo[3.2.1]octane-2,4-dione;dihydrochloride
Also Known As: 3-Azabicyclo(3.2.1)octane-2,4-dione, 1,8,8-trimethyl-3-(3-(4-(4-methylphenyl)-1-piperazinyl)propyl)-, dihydrochloride, 1,8,8-Trimethyl-3-[3-[4-(4-methylphenyl)piperazin-1-yl]propyl]-3-azabicyclo[3.2.1]octane-2,4-dione dihydrochloride, 1,8,8-Trimethyl-3-{3-[4-(4-methylphenyl)piperazin-1-yl]propyl}-3-azabicyclo[3.2.1]octane-2,4-dione--hydrogen chloride (1/2), 3-AZABICYCLO(3.2.1)OCTANE-2,4-DIONE, 1,8,8-TRIMETHYL-3-(3-(4-(4-METHYLPHENYL)-1-, 5,8,8-trimethyl-3-[3-[4-(4-methylphenyl)piperazin-1-yl]propyl]-3-azabicyclo[3.2.1]octane-2,4-dione dihydrochloride
Technical Specifications
| Molecular Formula | C24H37Cl2N3O2 |
| Molecular Weight | 469.2263 g/mol |
| XLogP | 4.16 |
| Topological Polar Surface Area (TPSA) | 43.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 469.2263 Da |
| Heavy Atoms | 31 |
| Complexity | 632.0 |
| SMILES | CC1=CC=C(C=C1)N2CCN(CC2)CCCN3C(=O)C4CCC(C3=O)(C4(C)C)C.Cl.Cl |
| InChIKey | ITOOCZAABMXTGI-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:276749
Property Insights of RefChem:276749
The XLogP value of 4.16 indicates that RefChem:276749 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.9 Ų, RefChem:276749 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:276749 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RefChem:276749?
The CAS number of RefChem:276749 is 90619-44-6.
What is the molecular formula of RefChem:276749?
The molecular formula of RefChem:276749 is C24H37Cl2N3O2.
What is the molecular weight of RefChem:276749?
The molecular weight of RefChem:276749 is 469.2263 g/mol.
Where can I buy RefChem:276749?
You can request a quote for RefChem:276749 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:276749?
Yes, CoreyChem provides custom synthesis services for RefChem:276749 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.