7-Hydroxyquetiapine
6-[4-[2-(2-hydroxyethoxy)ethyl]piperazin-1-yl]benzo[b][1,4]benzothiazepin-2-ol
Also Known As: 7-Hydroxy Quetiapine|7-HYDROXYQUETIAPINE|7-Hydroxy ICI 204636|ICI 214227|MSK10224-100M|7-Hydroxy Quetiapine (1.0 mg/mL in Methanol)|6-[4-[2-(2-hydroxyethoxy)ethyl]piperazin-1-yl]benzo[b][1,4]benzothiazepin-2-ol|Dibenzo[b,f][1,4]thiazepin-7-ol, 11-[4-[2-(2-hydroxyethoxy)ethyl]-1-piperazinyl]-|7-Hydroxy Quetiapine Solution in Methanol, 100ug/mL|Dibenzo(b,f)(1,4)thiazepin-7-ol, 11-(4-(2-(2-hydroxyethoxy)ethyl)-1-piperazinyl)-|Dibenzo[b,f][1,4]thiazepin-7-ol,11-[4-[2-(2-hydroxyethoxy)ethyl]-1-piperazinyl]-|11-(4-(2-(2-Hydroxyethoxy)ethyl)-1-piperazinyl)dibenzo(b,f)(1,4)thiazepin-7-ol|11-[4-[2-(2-Hydroxyethoxy)ethyl]-1-piperazinyl]dibenzo[b,f][1,4]thiazepin-7-ol|5,6,7,8-TETRAHYDRO-4H-CYCLOHEPTA[B]THIOPHENE-2-CARBOXYLICACID|11-(4-(2-(2-hydroxyethoxy)ethyl)piperazin-1-yl)dibenzo[b,f][1,4]thiazepin-7-ol|11-[4-[2-(2-Hydroxyethoxy)ethyl]-1-piperazinyl]-dibenzo[b,f][1,4]thiazepin-7-ol|11-[4-[2-(2-Hydroxyethoxy)ethyl]piperazino]dibenzo[b,f][1,4]thiazepine-7-ol|11-{4-[2-(2-Hydroxy-ethoxy)-ethyl]-piperazin-1-yl}-dibenzo[b,f][1,4]thiazepin-7-ol|11-{4-[2-(2-Hydroxyethoxy)ethyl]piperazin-1-yl}dibenzo[b,f][1,4]thiazepin-7-ol|2-(2-(7-Hydroxy-4-dibenzo(b,f)(1,4)thiazepine-11-yl-1-piperazinyl)ethoxy)ethanol|2-[2-[4-(7-Hydroxy-dibenzo[b,f][1,4]thiazepin-11-yl)piperazin-1-yl]ethoxy]ethanol|2-[2-[4-(7-Hydroxydibenzo[b,f][1,4]thiazepine-11-yl)piperazino]ethoxy]ethanol|10-{4-[2-(2-hydroxyethoxy)ethyl]piperazin-1-yl}-2-thia-9-azatricyclo[9.4.0.0(3),?]pentadeca-1(11),3,5,7,9,12,14-heptaen-5-ol
| Molecular Formula | C21H25N3O3S |
|---|---|
| Molecular Weight | 399.16165 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 93.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 399.16165 |
| Monoisotopic Mass | 399.16165 |
| Heavy Atoms | 28 |
| Complexity | 527.0 |
Chemical Identifiers
| CAS Number | 100-16-3 |
|---|---|
| SMILES | C1CN(CCN1CCOCCO)C2=NC3=C(C=C(C=C3)O)SC4=CC=CC=C42 |
| InChIKey | VEGVCHRFYPFJFO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
7-Hydroxyquetiapine (CAS 100-16-3), with molecular formula C21H25N3O3S and molecular weight 399.16165 g/mol. IUPAC: 6-[4-[2-(2-hydroxyethoxy)ethyl]piperazin-1-yl]benzo[b][1,4]benzothiazepin-2-ol.