TL;DR: Ricasetron (CAS 117086-68-7) is a chemical compound with molecular formula C19H27N3O and molecular weight 313.21542 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,3-dimethyl-N-[(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]-2H-indole-1-carboxamide
Also Known As: Ricasetron, Ricasetron [INN:BAN], Ricasetron [BAN:INN], RICASETRON [INN], Brl 46470
| Molecular Formula | C19H27N3O |
| Molecular Weight | 313.21542 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 35.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 313.21542 Da |
| Heavy Atoms | 23 |
| Complexity | 463.0 |
| SMILES | CC1(CN(C2=CC=CC=C21)C(=O)NC3C[C@H]4CC[C@@H](C3)N4C)C |
| InChIKey | ILXWRFDRNAKTDD-GOOCMWNKSA-N |
The XLogP value of 3.2 indicates that Ricasetron is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.6 Ų, Ricasetron exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ricasetron has 1 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 Ricasetron is 117086-68-7.
The molecular formula of Ricasetron is C19H27N3O.
The molecular weight of Ricasetron is 313.21542 g/mol.
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