In Stock
Drug-likeness Properties
sLogP
4.9521
HBD
2
HBA
5
AS112471-G1
Halides
Ketones
Fluorides
Morpholine
Aprepitant 95%
CAS: 170729-80-3
Molecular Formula
C23H21F7N4O3
Molecular Weight
534.43
MDL
MFCD08277635
Unit Size
Price per 1 g
€69.00
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PRODUCT ATTACHED TO REQUEST:
Aprepitant 95%
Catalogue Number: AS112471-G1
C.A.S / related C.A.S
170729-80-3
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AS112471-G1
General Information
| Catalog #: | AS112471-G1 |
|---|---|
| Formula: | C23H21F7N4O3 |
| Mass: | 534.43 |
| C.A.S. / related C.A.S: | 170729-80-3 |
| MDL: | MFCD08277635 |
| Appearance: | crystal -powder |
| Colour: | white - off white |
| Hazardous Classification: | Giftig (Toxic) |
| Storage Temp: | 2-7°C Kühlschrank / Refrigerate |
| Dangerous Goods in Excepted Quantities: | |
| Tariff Code: | 2934999090 |
| Stock: | > 5 |
| Material Safety Data Sheet: |
Computational Information
| SlogP: | 4.9521 |
|---|---|
| LabuteASA: | 204.7483434 |
| TPSA: | 83.24 |
| NumRotatableBonds: | 6 |
| NumHBD: | 2 |
| NumHBA: | 5 |
| NumHeavyAtoms: | 37 |
| NumRings: | 4 |