TL;DR: Picrasidine I (CAS 100234-59-1) is a chemical compound with molecular formula C14H12N2O2 and molecular weight 240.08987 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-ethenyl-4-methoxy-9H-pyrido[3,4-b]indol-8-ol
Also Known As: Picrasidine I, 1-ethenyl-4-methoxy-9H-pyrido[3,4-b]indol-8-ol, 4-methoxy-1-vinyl-9H-beta-carbolin-8-ol, HY-N3071, 9H-pyrido[3,4-b]indol-8-ol, 1-ethenyl-4-methoxy-
| Molecular Formula | C14H12N2O2 |
| Molecular Weight | 240.08987 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 58.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 240.08987 Da |
| Heavy Atoms | 18 |
| Complexity | 323.0 |
| SMILES | COC1=CN=C(C2=C1C3=C(N2)C(=CC=C3)O)C=C |
| InChIKey | JOHWQLSNGRWJRK-UHFFFAOYSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Picrasidine I. With a topological polar surface area (TPSA) of 58.1 Ų, Picrasidine I exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Picrasidine I 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 Picrasidine I is 100234-59-1.
The molecular formula of Picrasidine I is C14H12N2O2.
The molecular weight of Picrasidine I is 240.08987 g/mol.
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