- InChI
- InChI=1S/C11H21N5OS/c1-8(2)13-10-14-9(12-6-5-7-17-3)15-11(16-10)18-4/h8H,5-7H2,1-4H3,(H2,12,13,14,15,16)
- InChI Key
- DDUIUBPJPOKOMV-UHFFFAOYSA-N
- Formula
- C11H21N5OS
- SMILES
- COCCCNc1nc(NC(C)C)nc(SC)n1
- Molecular Weight1
- 271.38
- CAS
- 841-06-5
- Other Names
-
- 1,3,5-Triazine-2,4-diamine, N-(3-methoxypropyl)-N'-(1-methylethyl)-6-(methylthio)-
- 2-Isopropylamino-4-(3-methoxypropylamino)-6-methylthio-1,3,5-triazine
- 2-Isopropylamino-4-(3-methoxypropylamino)-6-methylthio-s-triazine
- 2-Methylthio-4-isopropylamino-6-(3-methoxypropylamino)-s-triazine
- 4-Isopropylamino-6-(3'-methoxypropylamino)-2-methythio-1,3,5-triazine
- G 36393
- Gesaran
- Gesaran 25
- Methoproptryne
- Methoproteryne
- Methoprotryn
- Methotryne
- Metoprotryn
- Metoprotryne
- s-Triazine, 2-(isopropylamino)-4-[(3-methoxypropyl)amino]-6-(methylthio)-
- 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.
- I : Polar retention indices.
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| log10WS | [-2.93; -2.93] |
|
|
| log10WS | -2.93 | Aq. Sol... | |
| log10WS | -2.93 | Estimat... | |
| logPoct/wat | 1.862 | Crippen Calculated Property | |
| McVol | 214.210 | ml/mol | McGowan Calculated Property |
| Inp | [2150.00; 2153.00] |
|
|
| Inp | 2150.00 | NIST | |
| Inp | 2153.00 | NIST | |
| Inp | 2150.00 | NIST | |
| I | [3202.00; 3202.00] |
|
|
| I | 3202.00 | NIST | |
| I | 3202.00 | NIST | |
| I | 3202.00 | NIST |
Similar Compounds
Find more compounds similar to Methoprotryne.
Sources
- Crippen Method
- Aqueous Solubility Prediction Method
- Estimated Solubility Method
- McGowan Method
- NIST Webbook
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