TL;DR: 1-(3-tert-butyl-1-methyl-4-oxoindeno[1,2-c]pyrazol-6-yl)-3-(2-methylphenyl)urea (CAS 1024523-14-5) is a chemical compound with molecular formula C23H24N4O2 and molecular weight 388.1899 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(3-tert-butyl-1-methyl-4-oxoindeno[2,1-d]pyrazol-6-yl)-3-(2-methylphenyl)urea
Also Known As: 1-(3-tert-butyl-1-methyl-4-oxoindeno[1,2-c]pyrazol-6-yl)-3-(2-methylphenyl)urea, N-(3-(TERT-BUTYL)-1-METHYL-4-OXOINDENO[2,3-D]PYRAZOL-6-YL)((2-METHYLPHENYL)AMINO)FORMAMIDE, 3-{3-tert-butyl-1-methyl-4-oxo-1H,4H-indeno[1,2-c]pyrazol-6-yl}-1-(2-methylphenyl)urea, 1-(3-tert-butyl-1-methyl-4-oxo-indeno[1,2-c]pyrazol-6-yl)-3-(o-tolyl)urea
| Molecular Formula | C23H24N4O2 |
| Molecular Weight | 388.1899 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 76.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 388.1899 Da |
| Heavy Atoms | 29 |
| Complexity | 645.0 |
| SMILES | CC1=CC=CC=C1NC(=O)NC2=CC3=C(C=C2)C4=C(C3=O)C(=NN4C)C(C)(C)C |
| InChIKey | RNQCIMAYXUALOD-UHFFFAOYSA-N |
The XLogP value of 4.0 indicates that 1-(3-tert-butyl-1-methyl-4-oxoindeno[1,2-c]pyrazol-6-yl)-3-(2-methylphenyl)urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3-tert-butyl-1-methyl-4-oxoindeno[1,2-c]pyrazol-6-yl)-3-(2-methylphenyl)urea. Following Lipinski's Rule of Five, 1-(3-tert-butyl-1-methyl-4-oxoindeno[1,2-c]pyrazol-6-yl)-3-(2-methylphenyl)urea has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-(3-tert-butyl-1-methyl-4-oxoindeno[1,2-c]pyrazol-6-yl)-3-(2-methylphenyl)urea is 1024523-14-5.
The molecular formula of 1-(3-tert-butyl-1-methyl-4-oxoindeno[1,2-c]pyrazol-6-yl)-3-(2-methylphenyl)urea is C23H24N4O2.
The molecular weight of 1-(3-tert-butyl-1-methyl-4-oxoindeno[1,2-c]pyrazol-6-yl)-3-(2-methylphenyl)urea is 388.1899 g/mol.
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