Account N-(2-(Diethylamino)ethyl)-2-(2-((4-fluorobenzyl)thio)-5-((1-methyl-1H-pyrazol-4-yl)methyl)-4-oxopyrimidin-1(4H)-yl)-N-((4'-(trifluoromethyl)-[1,1'-biphenyl]-4-yl)methyl)acetamide
- Catalog No. :
- ACAJJQ057
- CAS No. :
- 304694-39-1
- Molecular Formula :
- C38H40F4N6O2S
- Molecular Weight :
- 720.84
IUPAC Name:SB-435495
![N-(2-(Diethylamino)ethyl)-2-(2-((4-fluorobenzyl)thio)-5-((1-methyl-1H-pyrazol-4-yl)methyl)-4-oxopyrimidin-1(4H)-yl)-N-((4'-(trifluoromethyl)-[1,1'-biphenyl]-4-yl)methyl)acetamide structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | N-(2-(Diethylamino)ethyl)-2-(2-((4-fluorobenzyl)thio)-5-((1-methyl-1H-pyrazol-4-yl)methyl)-4-oxopyrimidin-1(4H)-yl)-N-((4'-(trifluoromethyl)-[1,1'-biphenyl]-4-yl)methyl)acetamide |
|---|---|
| IUPAC Name | SB-435495 |
| Molecular Formula | C38H40F4N6O2S |
| Molecular Weight | 720.84 |
| SMILES | O=C(N(CCN(CC)CC)CC1=CC=C(C2=CC=C(C(F)(F)F)C=C2)C=C1)CN(C(SCC3=CC=C(F)C=C3)=N4)C=C(CC5=CN(C)N=C5)C4=O |
| InChI Key | VGIQUSQBXZXBGW-UHFFFAOYSA-N |
| Synonym | SB-435495;1(4H)-Pyrimidineacetamide, N-[2-(diethylamino)ethyl]-2-[[(4-fluorophenyl)methyl]thio]-5-[(1-methyl-1H-pyrazol-4-yl)methyl]-4-oxo-N-[[4'-(trifluoromethyl)[1,1'-biphenyl]-4-yl]methyl]-;N-[2-(diethylamino)ethyl]-2-(2-{[(4-fluorophenyl)methyl]sulfanyl}-5-[(1-methyl-1H-pyrazol-4-yl)methyl]-4-oxo-1,4-dihydropyrimidin-1-yl)-N-{[4'-(trifluoromethyl)-[1,1'-biphenyl]-4-yl]methyl}acetamide;N-(2-(Diethylamino)ethyl)-2-(2-((4-fluorobenzyl)thio)-5-((1-methyl-1H-pyrazol-4-yl)methyl)-4-oxopyrimidin-1(4H)-yl)-N-((4'-(trifluoromethyl)-[1,1'-biphenyl]-4-yl)methyl)acetamide |
| CAS No. | 304694-39-1 |
| PubChem CID | 10417440 |
Safety Data
- Pictogram
- Signal Word
- Warning
- Hazard Statement(s)
- H302-H315-H319
- Precautionary Statement(s)
- P264-P270-P280-P301+P312+P330-P302+P352-P305+P351+P338-P332+P313-P337+P313-P362+P364-P501
Synthetic Route by SureRoute
2. ACAJJQ057 Molecular Building Block Synthetic Route
SB-435495 hydrochloride
SB-435495 ditartrate
N-(2-(Diethylamino)ethyl)-2-(2-((4-fluorobenzyl)thio)-4-oxo-4,5,6,7-tetrahydro-1H-cyclopenta[d]pyrimidin-1-yl)-N-((4'-(trifluoromethyl)-[1,1'-biphenyl]-4-yl)methyl)acetamide