Ketanserinol
3-[2-[4-[(4-fluorophenyl)-hydroxymethyl]piperidin-1-yl]ethyl]-1H-quinazoline-2,4-dione
Also Known As: Ketanserinol|Reduced ketanserin|KETANSERIN_met004|KetanserinolReduced ketanserin|R 46742|R-46742|R 46,742|2,4(1H,3H)-Quinazolinedione, 3-(2-(4-((4-fluorophenyl)hydroxymethyl)-1-piperidinyl)ethyl)-|3-[2-[4-[(4-fluorophenyl)-hydroxymethyl]piperidin-1-yl]ethyl]-1H-quinazoline-2,4-dione|3-(2-(4-((4-Fluorophenyl)hydroxymethyl)-1-piperidinyl)ethyl)-2,4-(1H,3H)quinazolinedione|3-[2-[4-[(4-fluorophenyl)hydroxymethyl]-1-piperidinyl]ethyl]-2,4(1H,3H)-quinazolinedione|3-(2-(4-((4-Fluorophenyl)hydroxymethyl)-1-piperidinyl)ethyl)-2,4(1H,3H)-quinazolinedione|3-(2-{4-[(4-Fluorophenyl)(hydroxy)methyl]piperidin-1-yl}ethyl)-2-hydroxyquinazolin-4(3H)-one
| Molecular Formula | C22H24FN3O3 |
|---|---|
| Molecular Weight | 397.18018 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 72.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 397.18018 |
| Monoisotopic Mass | 397.18018 |
| Heavy Atoms | 29 |
| Complexity | 588.0 |
Chemical Identifiers
| CAS Number | 76330-73-9 |
|---|---|
| SMILES | C1CN(CCC1C(C2=CC=C(C=C2)F)O)CCN3C(=O)C4=CC=CC=C4NC3=O |
| InChIKey | CSAITASUWRGAOT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ketanserinol (CAS 76330-73-9), with molecular formula C22H24FN3O3 and molecular weight 397.18018 g/mol. IUPAC: 3-[2-[4-[(4-fluorophenyl)-hydroxymethyl]piperidin-1-yl]ethyl]-1H-quinazoline-2,4-dione.
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