TL;DR: 7-Fluoro-5-(4-fluorophenyl)-1,3-dihydro-1,4-benzodiazepin-2-one (CAS 152720-50-8) is a chemical compound with molecular formula C15H10F2N2O and molecular weight 272.0761 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-fluoro-5-(4-fluorophenyl)-1,3-dihydro-1,4-benzodiazepin-2-one
Also Known As: AB00674711-01, F1596-1180, 7-fluoro-5-(4-fluorophenyl)-2,3-dihydro-1H-1,4-benzodiazepin-2-one, 7-fluoro-5-(4-fluorophenyl)-1,3-dihydro-1,4-benzodiazepin-2-one, 7-fluoro-5-(4-fluorophenyl)-1H-benzo[e][1,4]diazepin-2(3H)-one
| Molecular Formula | C15H10F2N2O |
| Molecular Weight | 272.0761 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 41.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 272.0761 Da |
| Heavy Atoms | 20 |
| Complexity | 405.0 |
| SMILES | C1C(=O)NC2=C(C=C(C=C2)F)C(=N1)C3=CC=C(C=C3)F |
| InChIKey | WBETYPMCGDQJDB-UHFFFAOYSA-N |
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Fluoro-5-(4-fluorophenyl)-1,3-dihydro-1,4-benzodiazepin-2-one. With a topological polar surface area (TPSA) of 41.5 Ų, 7-Fluoro-5-(4-fluorophenyl)-1,3-dihydro-1,4-benzodiazepin-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Fluoro-5-(4-fluorophenyl)-1,3-dihydro-1,4-benzodiazepin-2-one has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 7-Fluoro-5-(4-fluorophenyl)-1,3-dihydro-1,4-benzodiazepin-2-one is 152720-50-8.
The molecular formula of 7-Fluoro-5-(4-fluorophenyl)-1,3-dihydro-1,4-benzodiazepin-2-one is C15H10F2N2O.
The molecular weight of 7-Fluoro-5-(4-fluorophenyl)-1,3-dihydro-1,4-benzodiazepin-2-one is 272.0761 g/mol.
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