TL;DR: 5-(3-chloro-2-methylphenyl)-1-(4-nitrophenyl)-3-phenyl-1,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(3aH,5H)-dione (CAS 1023234-80-1) is a chemical compound with molecular formula C24H17ClN4O4 and molecular weight 460.09384 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-(3-chloro-2-methylphenyl)-1-(4-nitrophenyl)-3-phenyl-3a,6a-dihydropyrrolo[3,4-c]pyrazole-4,6-dione
Also Known As: 5-(3-chloro-2-methylphenyl)-1-(4-nitrophenyl)-3-phenyl-1,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(3aH,5H)-dione, 5-(3-chloro-2-methylphenyl)-1-(4-nitrophenyl)-3-phenyl-3a,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione, 5-(3-chloro-2-methylphenyl)-1-(4-nitrophenyl)-3-phenyl-3a,6a-dihydropyrrolo[3,4-c]pyrazole-4,6-dione
| Molecular Formula | C24H17ClN4O4 |
| Molecular Weight | 460.09384 g/mol |
| XLogP | 5.2 |
| Topological Polar Surface Area (TPSA) | 98.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 460.09384 Da |
| Heavy Atoms | 33 |
| Complexity | 831.0 |
| SMILES | CC1=C(C=CC=C1Cl)N2C(=O)C3C(C2=O)N(N=C3C4=CC=CC=C4)C5=CC=C(C=C5)[N+](=O)[O-] |
| InChIKey | DTWVLULITKZTEH-UHFFFAOYSA-N |
The XLogP value of 5.2 indicates that 5-(3-chloro-2-methylphenyl)-1-(4-nitrophenyl)-3-phenyl-1,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(3aH,5H)-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(3-chloro-2-methylphenyl)-1-(4-nitrophenyl)-3-phenyl-1,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(3aH,5H)-dione. Following Lipinski's Rule of Five, 5-(3-chloro-2-methylphenyl)-1-(4-nitrophenyl)-3-phenyl-1,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(3aH,5H)-dione has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 5-(3-chloro-2-methylphenyl)-1-(4-nitrophenyl)-3-phenyl-1,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(3aH,5H)-dione is 1023234-80-1.
The molecular formula of 5-(3-chloro-2-methylphenyl)-1-(4-nitrophenyl)-3-phenyl-1,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(3aH,5H)-dione is C24H17ClN4O4.
The molecular weight of 5-(3-chloro-2-methylphenyl)-1-(4-nitrophenyl)-3-phenyl-1,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(3aH,5H)-dione is 460.09384 g/mol.
You can request a quote for 5-(3-chloro-2-methylphenyl)-1-(4-nitrophenyl)-3-phenyl-1,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(3aH,5H)-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Yes, CoreyChem provides custom synthesis services for 5-(3-chloro-2-methylphenyl)-1-(4-nitrophenyl)-3-phenyl-1,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(3aH,5H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.
Request a quote for CAS 1023234-80-1. Our professional technical team will respond with pricing and lead time.