- InChI
- InChI=1S/C16H19N3S/c1-12(18(2)3)11-19-13-7-4-5-8-14(13)20-15-9-6-10-17-16(15)19/h4-10,12H,11H2,1-3H3
- InChI Key
- OQJBSDFFQWMKBQ-UHFFFAOYSA-N
- Formula
- C16H19N3S
- SMILES
- CC(CN1c2ccccc2Sc2cccnc21)N(C)C
- Molecular Weight1
- 285.41
- CAS
- 482-15-5
- Other Names
-
- 10H-Pyrido[3,2-b][1,4]benzothiazine-10-ethanamine, N,N,«alpha»-trimethyl-
- 10H-Pyrido[3,2-b][1,4]benzothiazine, 10-[2-(dimethylamino)propyl]-
- Andantol
- Andanton
- AY 56012
- D 201
- Dimethylaminoisopropylazaphenothiazine
- Nilergex
- Odantol
- Udantol
- 10-(2-Dimethylaminopropyl)-1-azaphenothiazine
- 10-(2-Dimethylaminopropyl)-10H-pyrido[3,2-b][1,4]benzothiazine
- 10-(2-Dimethylaminopropyl)-9-thia-1,10-diazaanthracene
- 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.
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| log10WS | -3.96 | Crippen Calculated Property | |
| logPoct/wat | 3.634 | Crippen Calculated Property | |
| McVol | 224.210 | ml/mol | McGowan Calculated Property |
| Inp | [2245.00; 2268.00] |
|
|
| Inp | 2250.00 | NIST | |
| Inp | 2245.00 | NIST | |
| Inp | 2268.00 | NIST | |
| Inp | 2267.00 | NIST | |
| Inp | 2267.00 | NIST |
Similar Compounds
Find more compounds similar to Isothipendyl.
Sources
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