TL;DR: 1H-Indeno(1,2-b)pyridine, 2,3,4,4a,5,9b-hexahydro-5-(4-aminophenyl)-, (-)- (CAS 107035-12-1) is a chemical compound with molecular formula C18H20N2 and molecular weight 264.16266 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[(4aR,5S,9bR)-2,3,4,4a,5,9b-hexahydro-1H-indeno[1,2-b]pyridin-5-yl]aniline
Also Known As: Sid 706038, (-)-2,3,4,4a,5,9b-Hexahydro-5-(4-aminophenyl)-1H-indeno(1,2-b)pyridine, 1H-Indeno(1,2-b)pyridine, 2,3,4,4a,5,9b-hexahydro-5-(4-aminophenyl)-, (-)-, (-)-5-(4-Aminophenyl)-2,3,4,4a,5,9b-hexahydro-1H-indeno(1,2-b)pyridine, Benzenamine, 4-(2,3,4,4a,5,9b-hexahydro-1H-indeno(1,2-b)pyridin-5-yl)-, (4a-alpha,5-alpha,9b-alpha)-
| Molecular Formula | C18H20N2 |
| Molecular Weight | 264.16266 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 38.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 264.16266 Da |
| Heavy Atoms | 20 |
| Complexity | 334.0 |
| SMILES | C1C[C@@H]2[C@H](C3=CC=CC=C3[C@@H]2NC1)C4=CC=C(C=C4)N |
| InChIKey | WRODVCIVODHZFB-SQNIBIBYSA-N |
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Indeno(1,2-b)pyridine, 2,3,4,4a,5,9b-hexahydro-5-(4-aminophenyl)-, (-)-. With a topological polar surface area (TPSA) of 38.1 Ų, 1H-Indeno(1,2-b)pyridine, 2,3,4,4a,5,9b-hexahydro-5-(4-aminophenyl)-, (-)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Indeno(1,2-b)pyridine, 2,3,4,4a,5,9b-hexahydro-5-(4-aminophenyl)-, (-)- 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 1H-Indeno(1,2-b)pyridine, 2,3,4,4a,5,9b-hexahydro-5-(4-aminophenyl)-, (-)- is 107035-12-1.
The molecular formula of 1H-Indeno(1,2-b)pyridine, 2,3,4,4a,5,9b-hexahydro-5-(4-aminophenyl)-, (-)- is C18H20N2.
The molecular weight of 1H-Indeno(1,2-b)pyridine, 2,3,4,4a,5,9b-hexahydro-5-(4-aminophenyl)-, (-)- is 264.16266 g/mol.
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