TL;DR: Metaclazepam (CAS 84031-17-4) is a chemical compound with molecular formula C18H18BrClN2O and molecular weight 392.0291 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-bromo-5-(2-chlorophenyl)-2-(methoxymethyl)-1-methyl-2,3-dihydro-1,4-benzodiazepine
Also Known As: Metaclazepam, Brometazepam, Metuclazepam, Metaclazepamum, Talis
Top 5 of 10 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C18H18BrClN2O |
| Molecular Weight | 392.0291 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 24.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 392.0291 Da |
| Heavy Atoms | 23 |
| Complexity | 433.0 |
| SMILES | CN1C(CN=C(C2=C1C=CC(=C2)Br)C3=CC=CC=C3Cl)COC |
| InChIKey | WABYCCJHARSRBH-UHFFFAOYSA-N |
The XLogP value of 4.4 indicates that Metaclazepam is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.8 Ų, Metaclazepam exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Metaclazepam has 0 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 Metaclazepam is 84031-17-4.
The molecular formula of Metaclazepam is C18H18BrClN2O.
The molecular weight of Metaclazepam is 392.0291 g/mol.
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