TL;DR: 4-(9-CL-5-(4-CL-PH)-1,10B-Dihydropyrazolo(1,5-C)(1,3)benzoxazin-2-YL)PH ME ether (CAS 303061-23-6) is a chemical compound with molecular formula C23H18Cl2N2O2 and molecular weight 424.07452 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
9-chloro-5-(4-chlorophenyl)-2-(4-methoxyphenyl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine
Also Known As: BAS 00890032, 9-chloro-5-(4-chlorophenyl)-2-(4-methoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine, 4-(9-CL-5-(4-CL-PH)-1,10B-DIHYDROPYRAZOLO(1,5-C)(1,3)BENZOXAZIN-2-YL)PH ME ETHER, 9-Chloro-5-(4-chlorophenyl)-2-(4-methoxyphenyl)-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazine, 9-chloro-5-(4-chlorophenyl)-2-(4-methoxyphenyl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine
| Molecular Formula | C23H18Cl2N2O2 |
| Molecular Weight | 424.07452 g/mol |
| XLogP | 6.1 |
| Topological Polar Surface Area (TPSA) | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 424.07452 Da |
| Heavy Atoms | 29 |
| Complexity | 602.0 |
| SMILES | COC1=CC=C(C=C1)C2=NN3C(C2)C4=C(C=CC(=C4)Cl)OC3C5=CC=C(C=C5)Cl |
| InChIKey | NAYSTQYIMRWPFE-UHFFFAOYSA-N |
The XLogP value of 6.1 indicates that 4-(9-CL-5-(4-CL-PH)-1,10B-Dihydropyrazolo(1,5-C)(1,3)benzoxazin-2-YL)PH ME ether is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.1 Ų, 4-(9-CL-5-(4-CL-PH)-1,10B-Dihydropyrazolo(1,5-C)(1,3)benzoxazin-2-YL)PH ME ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(9-CL-5-(4-CL-PH)-1,10B-Dihydropyrazolo(1,5-C)(1,3)benzoxazin-2-YL)PH ME ether has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 4-(9-CL-5-(4-CL-PH)-1,10B-Dihydropyrazolo(1,5-C)(1,3)benzoxazin-2-YL)PH ME ether is 303061-23-6.
The molecular formula of 4-(9-CL-5-(4-CL-PH)-1,10B-Dihydropyrazolo(1,5-C)(1,3)benzoxazin-2-YL)PH ME ether is C23H18Cl2N2O2.
The molecular weight of 4-(9-CL-5-(4-CL-PH)-1,10B-Dihydropyrazolo(1,5-C)(1,3)benzoxazin-2-YL)PH ME ether is 424.07452 g/mol.
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