TL;DR: RefChem:238598 (CAS 88763-21-7) is a chemical compound with molecular formula C18H20N2O and molecular weight 280.15756 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4aS,5R,9bS)-5-(4-aminophenyl)-2,3,4,4a,5,9b-hexahydro-1H-indeno[1,2-b]pyridin-7-ol
Also Known As: 1H-Indeno(1,2-b)pyridin-7-ol, 2,3,4,4a,5,9b-hexahydro-5-(4-aminophenyl)-, (4a-alpha,5-alpha,9b-alpha)-, (4aS,5R,9bS)-5-(4-aminophenyl)-2,3,4,4a,5,9b-hexahydro-1H-indeno[1,2-b]pyridin-7-ol, 5-(4-Aminophenyl)-2,3,4,4a,5,9b-hexahydro-1H-indeno[1,2-b]pyridin-7-ol, BRN 4704503
| Molecular Formula | C18H20N2O |
| Molecular Weight | 280.15756 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 58.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 280.15756 Da |
| Heavy Atoms | 21 |
| Complexity | 366.0 |
| SMILES | C1C[C@H]2[C@@H](C3=C([C@H]2NC1)C=CC(=C3)O)C4=CC=C(C=C4)N |
| InChIKey | JXGVJGULDBBMPP-RYQLBKOJSA-N |
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:238598. With a topological polar surface area (TPSA) of 58.3 Ų, RefChem:238598 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:238598 has 3 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 RefChem:238598 is 88763-21-7.
The molecular formula of RefChem:238598 is C18H20N2O.
The molecular weight of RefChem:238598 is 280.15756 g/mol.
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