N-(3-GUANIDINO-4-METHYLPHENYL)-4-(METHYLPIPERAZINE-1-YL-METHYL)BENZAMIDE
Bezeichnung:N-(3-GUANIDINO-4-METHYLPHENYL)-4-(METHYLPIPERAZINE-1-YL-METHYL)BENZAMIDE
CAS-Nr581076-65-5
Englisch Name:N-(3-GUANIDINO-4-METHYLPHENYL)-4-(METHYLPIPERAZINE-1-YL-METHYL)BENZAMIDE
CBNumberCB6649081
SummenformelC21H28N6O
Molgewicht380.49
MOL-DateiMol file
N-(3-GUANIDINO-4-METHYLPHENYL)-4-(METHYLPIPERAZINE-1-YL-METHYL)BENZAMIDE physikalisch-chemischer Eigenschaften
| Schmelzpunkt | 82-107°C dec. |
| Dichte | 1.24±0.1 g/cm3(Predicted) |
| storage temp. | Hygroscopic, Refrigerator, under inert atmosphere |
| Löslichkeit | DMSO (Slightly), Methanol (Slightly) |
| pka | 13.66±0.70(Predicted) |
| Aggregatzustand | Solid |
| Farbe | White to Pale Beige |
| Stabilität | Hygroscopic |
| InChI | InChI=1S/C21H28N6O/c1-15-3-8-18(13-19(15)25-21(22)23)24-20(28)17-6-4-16(5-7-17)14-27-11-9-26(2)10-12-27/h3-8,13H,9-12,14H2,1-2H3,(H,24,28)(H4,22,23,25) |
| InChIKey | AJNIAMJOBVYWFM-UHFFFAOYSA-N |
| SMILES | C(NC1=CC=C(C)C(NC(N)=N)=C1)(=O)C1=CC=C(CN2CCN(C)CC2)C=C1 |