TL;DR: 1H-3-Benzazepine-7,8-diol, 2,3,4,5-tetrahydro-1-phenyl-3-(2-propenyl)-, (S)- (CAS 139689-10-4) is a chemical compound with molecular formula C19H21NO2 and molecular weight 295.15723 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(5S)-5-phenyl-3-prop-2-enyl-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol
Also Known As: SKF-77434, (S)-, S-(-)-Apd, Lopac-S-168, Lopac0_001143, (S)-skf-77434
| Molecular Formula | C19H21NO2 |
| Molecular Weight | 295.15723 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 43.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 295.15723 Da |
| Heavy Atoms | 22 |
| Complexity | 366.0 |
| SMILES | C=CCN1CCC2=CC(=C(C=C2[C@@H](C1)C3=CC=CC=C3)O)O |
| InChIKey | QBUVZVXIRYFENV-KRWDZBQOSA-N |
The XLogP value of 3.6 indicates that 1H-3-Benzazepine-7,8-diol, 2,3,4,5-tetrahydro-1-phenyl-3-(2-propenyl)-, (S)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.7 Ų, 1H-3-Benzazepine-7,8-diol, 2,3,4,5-tetrahydro-1-phenyl-3-(2-propenyl)-, (S)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-3-Benzazepine-7,8-diol, 2,3,4,5-tetrahydro-1-phenyl-3-(2-propenyl)-, (S)- has 2 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 1H-3-Benzazepine-7,8-diol, 2,3,4,5-tetrahydro-1-phenyl-3-(2-propenyl)-, (S)- is 139689-10-4.
The molecular formula of 1H-3-Benzazepine-7,8-diol, 2,3,4,5-tetrahydro-1-phenyl-3-(2-propenyl)-, (S)- is C19H21NO2.
The molecular weight of 1H-3-Benzazepine-7,8-diol, 2,3,4,5-tetrahydro-1-phenyl-3-(2-propenyl)-, (S)- is 295.15723 g/mol.
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