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| Name | PKC-theta inhibitor |
|---|---|
| Synonyms | 4-N-[[4-(aminomethyl)cyclohexyl]methyl]-5-nitro-2-N-[[2-(trifluoromethoxy)phenyl]methyl]pyrimidine-2,4-diamine |
| Molecular Structure | ![CAS # 736048-65-0, PKC-theta inhibitor, 4-N-[[4-(aminomethyl)cyclohexyl]methyl]-5-nitro-2-N-[[2-(trifluoromethoxy)phenyl]methyl]pyrimidine-2,4-diamine](/structures/736048-65-0.gif) |
| Molecular Formula | C20H25F3N6O3 |
| Molecular Weight | 454.45 |
| CAS Registry Number | 736048-65-0 |
| SMILES | C1CC(CCC1CN)CNC2=NC(=NC=C2[N+](=O)[O-])NCC3=CC=CC=C3OC(F)(F)F |
| Solubility | 1.63 mg/L (25 ºC water) |
|---|---|
| Density | 1.4±0.1 g/cm3, Calc.* |
| Index of Refraction | 1.594, Calc.* |
| Melting point | 228.04 ºC |
| Boiling Point | 533.06 ºC, 597.1±60.0 ºC (760 mmHg), Calc.* |
| Flash Point | 314.9±32.9 ºC, Calc.* |
| * | Calculated using Advanced Chemistry Development (ACD/Labs) Software. |
| Hazard Symbols |
GHS07 Warning Details |
|---|---|
| Hazard Statements | H302-H315-H319-H335 Details |
| Precautionary Statements | P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501 Details |
| SDS | Available |
| Market Analysis Reports |
| List of Reports Available for PKC-theta inhibitor |