- InChI
- InChI=1S/C18H18ClN3O/c1-21-8-10-22(11-9-21)18-14-12-13(19)6-7-16(14)23-17-5-3-2-4-15(17)20-18/h2-7,12H,8-11H2,1H3
- InChI Key
- XJGVXQDUIWGIRW-UHFFFAOYSA-N
- Formula
- C18H18ClN3O
- SMILES
-
CN1CCN(C2=Nc3ccccc3Oc3ccc(Cl)c
c32)CC1 - Molecular Weight1
- 327.81
- CAS
- 1977-10-2
- Other Names
-
- 2-Chloro-11-(4-methyl-1-piperazinyl)dibenz[b,f][1,4]oxazepine
- 2-Chloro-11-(4-methylpiperazino)dibenz[b,f][1,4]oxazepine
- 8-chloro-6-(4-methylpiperazin-1-yl)benzo[b][1,5]benzoxazepine
- CL-62362
- CL-71563
- Cloxazepine
- Dibenz[b,f][1,4]oxazepine, 2-chloro-11-(4-methyl-1-piperazinyl)-
- Dibenzacepin
- Dibenzoazepine
- HF3170
- LW 3170
- Loxapin
- Loxepine
- Loxitane
- Loxitane IM
- Oxilapine
- S-805
- SUM 3170
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Inp : Non-polar retention indices.
- Tfus : Normal melting (fusion) point (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| log10WS | -4.42 | Aq. Sol... | |
| logPoct/wat | 3.771 | Crippen Calculated Property | |
| McVol | 238.990 | ml/mol | McGowan Calculated Property |
| Inp | [2530.00; 2542.00] |
|
|
| Inp | 2542.00 | NIST | |
| Inp | 2542.00 | NIST | |
| Inp | 2530.00 | NIST | |
| Inp | 2542.00 | NIST | |
| Tfus | 382.65 | K | Aq. Sol... |
Similar Compounds
Find more compounds similar to Loxapine.
Sources
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