TL;DR: 2-{4-[4-(Diphenylmethyl)piperazin-1-yl]quinazolin-2-yl}phenol (CAS 433971-04-1) is a chemical compound with molecular formula C31H28N4O and molecular weight 472.22632 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[4-(4-benzhydrylpiperazin-1-yl)quinazolin-2-yl]phenol
Also Known As: 2-(4-(4-benzhydrylpiperazin-1-yl)quinazolin-2-yl)phenol, 2-{4-[4-(diphenylmethyl)piperazin-1-yl]quinazolin-2-yl}phenol, 2-[4-(4-benzhydrylpiperazin-4-ium-1-yl)quinazolin-2-yl]phenolate, 6-[4-(4-benzhydrylpiperazin-1-yl)-1H-quinazolin-2-ylidene]cyclohexa-2,4-dien-1-one, (6Z)-6-[4-(4-benzhydrylpiperazin-1-yl)-1H-quinazolin-2-ylidene]cyclohexa-2,4-dien-1-one
| Molecular Formula | C31H28N4O |
| Molecular Weight | 472.22632 g/mol |
| XLogP | 6.3 |
| Topological Polar Surface Area (TPSA) | 52.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 472.22632 Da |
| Heavy Atoms | 36 |
| Complexity | 651.0 |
| SMILES | C1CN(CCN1C2=NC(=NC3=CC=CC=C32)C4=CC=CC=C4O)C(C5=CC=CC=C5)C6=CC=CC=C6 |
| InChIKey | CEJPLORHALXXMN-UHFFFAOYSA-N |
The XLogP value of 6.3 indicates that 2-{4-[4-(Diphenylmethyl)piperazin-1-yl]quinazolin-2-yl}phenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.5 Ų, 2-{4-[4-(Diphenylmethyl)piperazin-1-yl]quinazolin-2-yl}phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-{4-[4-(Diphenylmethyl)piperazin-1-yl]quinazolin-2-yl}phenol has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 2-{4-[4-(Diphenylmethyl)piperazin-1-yl]quinazolin-2-yl}phenol is 433971-04-1.
The molecular formula of 2-{4-[4-(Diphenylmethyl)piperazin-1-yl]quinazolin-2-yl}phenol is C31H28N4O.
The molecular weight of 2-{4-[4-(Diphenylmethyl)piperazin-1-yl]quinazolin-2-yl}phenol is 472.22632 g/mol.
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