TL;DR: (Z)-3-benzyl-2-((1-ethyl-2-oxoindolin-3-ylidene)methyl)quinazolin-4(3H)-one (CAS 361179-27-3) is a chemical compound with molecular formula C26H21N3O2 and molecular weight 407.1634 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-benzyl-2-[(Z)-(1-ethyl-2-oxoindol-3-ylidene)methyl]quinazolin-4-one
Also Known As: (Z)-3-benzyl-2-((1-ethyl-2-oxoindolin-3-ylidene)methyl)quinazolin-4(3H)-one, 3-benzyl-2-[(Z)-(1-ethyl-2-oxoindol-3-ylidene)methyl]quinazolin-4-one, 3-BENZYL-2-{[(3Z)-1-ETHYL-2-OXO-2,3-DIHYDRO-1H-INDOL-3-YLIDENE]METHYL}-3,4-DIHYDROQUINAZOLIN-4-ONE
| Molecular Formula | C26H21N3O2 |
| Molecular Weight | 407.1634 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 53.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 407.1634 Da |
| Heavy Atoms | 31 |
| Complexity | 767.0 |
| SMILES | CCN1C2=CC=CC=C2/C(=C/C3=NC4=CC=CC=C4C(=O)N3CC5=CC=CC=C5)/C1=O |
| InChIKey | QTEHRKVUMCVDDW-PGMHBOJBSA-N |
The XLogP value of 3.7 indicates that (Z)-3-benzyl-2-((1-ethyl-2-oxoindolin-3-ylidene)methyl)quinazolin-4(3H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.0 Ų, (Z)-3-benzyl-2-((1-ethyl-2-oxoindolin-3-ylidene)methyl)quinazolin-4(3H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (Z)-3-benzyl-2-((1-ethyl-2-oxoindolin-3-ylidene)methyl)quinazolin-4(3H)-one 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 (Z)-3-benzyl-2-((1-ethyl-2-oxoindolin-3-ylidene)methyl)quinazolin-4(3H)-one is 361179-27-3.
The molecular formula of (Z)-3-benzyl-2-((1-ethyl-2-oxoindolin-3-ylidene)methyl)quinazolin-4(3H)-one is C26H21N3O2.
The molecular weight of (Z)-3-benzyl-2-((1-ethyl-2-oxoindolin-3-ylidene)methyl)quinazolin-4(3H)-one is 407.1634 g/mol.
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