- InChI
- InChI=1S/C21H23N3OS/c22-15-16-6-7-21-19(14-16)24(18-4-1-2-5-20(18)26-21)11-3-10-23-12-8-17(25)9-13-23/h1-2,4-7,14,17,25H,3,8-13H2
- InChI Key
- LUALIOATIOESLM-UHFFFAOYSA-N
- Formula
- C21H23N3OS
- SMILES
-
N#Cc1ccc2c(c1)N(CCCN1CCC(O)CC1
)c1ccccc1S2 - Molecular Weight1
- 365.49
- CAS
- 2622-26-6
- Other Names
-
- 10-(3-(4-Hydroxypiperidino)propyl)phenothiazine-2-carbonitrile
- 10H-Phenothiazine-2-carbonitrile, 10-[3-(4-hydroxy-1-piperidinyl)propyl]-
- 2-Cyano-10-(3-(4-hydroxy-1-piperidyl)propyl)phenothiazine
- 2-Cyano-10-(3-(4-hydroxypiperidino)propyl)phenothiazine
- 4-Piperidinol, 1-(3-(2-cyano-10-phenothiazinyl)propyl)-
- 6909 RP
- Aolept
- Bayer 1409
- Cyano-3 ((hydroxy-4 piperidyl-1)-3 propyl)-10 phenothiazine
- F.I. 6145
- IC 6002
- Nelactil
- Nemactil
- Neulactil
- Neuleptil
- Periciazinum
- Pericyazine
- Phenothiazine-2-carbonitrile, 10-[3-(4-hydroxypiperidino)propyl]-
- Piperocyanomazine
- Propericiazine
- RP 8908
- RP 8909
- SKF 20,716
- WH 7508
- ω : Acentric Factor.
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 0.8876 | Relay (1.0) Calculated Property | |
| ΔfG° | 405.74 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | 123.91 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 156.44 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.82 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.98 | Aq. Solubility Prediction | |
| logPoct/wat | 4.008 | Crippen Calculated Property | |
| McVol | 281.070 | ml/mol | McGowan Calculated Property |
| Pc | 1428.27 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | [3207.00; 3249.00] |
|
|
| Inp | 3225.00 | NIST | |
| Inp | 3227.00 | NIST | |
| Inp | 3230.00 | NIST | |
| Inp | 3207.00 | NIST | |
| Inp | 3249.00 | NIST | |
| Inp | 3230.00 | NIST | |
| Inp | 3225.00 | NIST | |
| Inp | 3249.00 | NIST | |
| Inp | 3207.00 | NIST | |
| Inp | 3227.00 | NIST | |
| Tboil | 789.15 | K | Relay (1.0) Calculated Property |
| Tc | 1094.47 | K | Relay (1.0) Calculated Property |
| Tfus | 375.75 | K | Aq. Solubility Prediction |
| Vc | 1.004 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Periciazine.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Aqueous Solubility Prediction Method
- McGowan Method
- NIST Webbook
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