C25H17BrClN3O3
TL;DR: C25H17BrClN3O3 (CAS 1022410-40-7) is a chemical compound with molecular formula C25H17BrClN3O3 and molecular weight 521.01416 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-benzoyl-1-(4-bromophenyl)-5-(3-chloro-2-methylphenyl)-3a,6a-dihydropyrrolo[3,4-c]pyrazole-4,6-dione
Also Known As: 1-(4-bromophenyl)-5-(3-chloro-2-methylphenyl)-3-(phenylcarbonyl)-3a,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione, 3-benzoyl-1-(4-bromophenyl)-5-(3-chloro-2-methylphenyl)-1,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(3aH,5H)-dione, 3-benzoyl-1-(4-bromophenyl)-5-(3-chloro-2-methylphenyl)-3a,6a-dihydropyrrolo[3,4-c]pyrazole-4,6-dione, C25H17BrClN3O3
Technical Specifications
| Molecular Formula | C25H17BrClN3O3 |
| Molecular Weight | 521.01416 g/mol |
| XLogP | 5.6 |
| Topological Polar Surface Area (TPSA) | 70.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 521.01416 Da |
| Heavy Atoms | 33 |
| Complexity | 837.0 |
| SMILES | CC1=C(C=CC=C1Cl)N2C(=O)C3C(C2=O)N(N=C3C(=O)C4=CC=CC=C4)C5=CC=C(C=C5)Br |
| InChIKey | YNWQZIVVYMLXNM-UHFFFAOYSA-N |
Chemical Property Profile of C25H17BrClN3O3
Property Insights of C25H17BrClN3O3
The XLogP value of 5.6 indicates that C25H17BrClN3O3 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.1 Ų falls within the moderate polarity range, balancing permeability and solubility for C25H17BrClN3O3. Following Lipinski's Rule of Five, C25H17BrClN3O3 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of C25H17BrClN3O3?
The CAS number of C25H17BrClN3O3 is 1022410-40-7.
What is the molecular formula of C25H17BrClN3O3?
The molecular formula of C25H17BrClN3O3 is C25H17BrClN3O3.
What is the molecular weight of C25H17BrClN3O3?
The molecular weight of C25H17BrClN3O3 is 521.01416 g/mol.
Where can I buy C25H17BrClN3O3?
You can request a quote for C25H17BrClN3O3 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for C25H17BrClN3O3?
Yes, CoreyChem provides custom synthesis services for C25H17BrClN3O3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.