CAS Number269055-15-4
Synonymsetravirine; 4-({6-Amino-5-bromo-2-[(4-cyanophenyl)amino]-4-pyrimidinyl}oxy)-3,5-dimethylbenzonitrile; tmc 125
Molecular FormulaC20H15BrN6O
Molecular Weight435.28
Purity≥98 (HPLC)%
Density1.6±0.1 g/cm3
Boiling Point637.4±65.0 °C at 760 mmHg
Melting Point265ºC (dec.)
Appearancepowder
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 269055-15-4 |
| Catalog No. | 2A-9060085 |
| Chinese Name | 依曲韦林 |
| Synonyms | etravirine; 4-({6-Amino-5-bromo-2-[(4-cyanophenyl)amino]-4-pyrimidinyl}oxy)-3,5-dimethylbenzonitrile; tmc 125 |
| Molecular Formula | C20H15BrN6O |
| Molecular Weight | 435.28 |
| Purity | ≥98 (HPLC) |
| Density | 1.6±0.1 g/cm3 |
| Boiling Point | 637.4±65.0 °C at 760 mmHg |
| Melting Point | 265ºC (dec.) |
| Appearance | powder |
| Storage Condition | -20°C Freezer |
| Application | Etravirine is a non-nucleoside reverse transcriptase inhibitor (NNRTI) used to treat HIV. |
| MDL Number | MFCD09837879 |
| SMILES | Brc1c(nc(nc1Oc3c(cc(cc3C)C#N)C)Nc2ccc(cc2)C#N)N |
| InChI | 1S/C20H15BrN6O/c1-11-7-14(10-23)8-12(2)17(11)28-19-16(21)18(24)26-20(27-19)25-15-5-3-13(9-22)4-6-15/h3-8H,1-2H3,(H3,24,25,26,27) |
| InChI Key | PYGWGZALEOIKDF-UHFFFAOYSA-N |
| NACRES Code | NA.77 |
| UNSPSC | 12352200 |
| MSDS | msds/60085_1_269055_15_4.pdf |
| Transport Info | Product Name: Etravirine (TMC125) |
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