TL;DR: Piperazine, 1-(cyclopropylmethyl)-4-(diphenylmethyl)-, dihydrochloride (CAS 113913-37-4) is a chemical compound with molecular formula C21H28Cl2N2 and molecular weight 378.16296 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-benzhydryl-4-(cyclopropylmethyl)piperazine;dihydrochloride
Also Known As: 1-Benzhydryl-4-cyclopropylmethyl-piperazine dihydrochloride, Piperazine, 1-(cyclopropylmethyl)-4-(diphenylmethyl)-, dihydrochloride, 1-(Cyclopropylmethyl)-4-(diphenylmethyl)piperazine dihydrochloride, 1-benzhydryl-4-(cyclopropylmethyl)piperazine dihydrochloride, 1-(Cyclopropylmethyl)-4-(diphenylmethyl)piperazine--hydrogen chloride (1/2)
| Molecular Formula | C21H28Cl2N2 |
| Molecular Weight | 378.16296 g/mol |
| XLogP | 4.6472 |
| Topological Polar Surface Area (TPSA) | 6.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 378.16296 Da |
| Heavy Atoms | 25 |
| Complexity | 327.0 |
| SMILES | C1CC1CN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4.Cl.Cl |
| InChIKey | XJEMICDDHVFLAM-UHFFFAOYSA-N |
The XLogP value of 4.6472 indicates that Piperazine, 1-(cyclopropylmethyl)-4-(diphenylmethyl)-, dihydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 6.5 Ų, Piperazine, 1-(cyclopropylmethyl)-4-(diphenylmethyl)-, dihydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Piperazine, 1-(cyclopropylmethyl)-4-(diphenylmethyl)-, dihydrochloride has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Piperazine, 1-(cyclopropylmethyl)-4-(diphenylmethyl)-, dihydrochloride is 113913-37-4.
The molecular formula of Piperazine, 1-(cyclopropylmethyl)-4-(diphenylmethyl)-, dihydrochloride is C21H28Cl2N2.
The molecular weight of Piperazine, 1-(cyclopropylmethyl)-4-(diphenylmethyl)-, dihydrochloride is 378.16296 g/mol.
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