TL;DR: 2,10-Dimethyl-4-(4-methyl-1-piperazinyl)-10H-thieno-[2,3-b][1,5]benzodiazepine (CAS 155817-84-8) is a chemical compound with molecular formula C18H22N4S and molecular weight 326.15652 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,10-dimethyl-4-(4-methylpiperazin-1-yl)thieno[2,3-b][1,5]benzodiazepine
Also Known As: Olanzapine Impurity 32, J2.313.294J, (E)-2,10-diMethyl-4-(4-Methylpiperazin-1-yl)-10H-benzo[b]thieno[2,3-e][1,4]diazepine, 2,10-Dimethyl-4-(4-methyl-1-piperazinyl)-10H-thieno-[2,3-b][1,5]benzodiazepine, 2,10-Dimethyl-4-(4-methyl-1-piperazinyl)-10H-thieno[2,3-b][1,5]benzodiazepine
| Molecular Formula | C18H22N4S |
| Molecular Weight | 326.15652 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 50.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 326.15652 Da |
| Heavy Atoms | 23 |
| Complexity | 460.0 |
| SMILES | CC1=CC2=C(S1)N(C3=CC=CC=C3N=C2N4CCN(CC4)C)C |
| InChIKey | IKJAUWADCAXADK-UHFFFAOYSA-N |
The XLogP value of 3.0 indicates that 2,10-Dimethyl-4-(4-methyl-1-piperazinyl)-10H-thieno-[2,3-b][1,5]benzodiazepine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.3 Ų, 2,10-Dimethyl-4-(4-methyl-1-piperazinyl)-10H-thieno-[2,3-b][1,5]benzodiazepine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,10-Dimethyl-4-(4-methyl-1-piperazinyl)-10H-thieno-[2,3-b][1,5]benzodiazepine has 0 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 2,10-Dimethyl-4-(4-methyl-1-piperazinyl)-10H-thieno-[2,3-b][1,5]benzodiazepine is 155817-84-8.
The molecular formula of 2,10-Dimethyl-4-(4-methyl-1-piperazinyl)-10H-thieno-[2,3-b][1,5]benzodiazepine is C18H22N4S.
The molecular weight of 2,10-Dimethyl-4-(4-methyl-1-piperazinyl)-10H-thieno-[2,3-b][1,5]benzodiazepine is 326.15652 g/mol.
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