CS-1003054
Elagolix Impurity 52
Manufacturer: ChemScene
CAS Number: 2409132-64-3
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₃₈H₄₀F₅N₃O₆
Molecular Weight
729.73
Synonyms
None
SMILES
C(C(CC(C)=O)(C)C)C1=C(C(=O)N(C[C@H](NCCCC(O)=O)C2=CC=CC=C2)C(=O)N1CC3=C(C(F)(F)F)C=CC=C3F)C4=C(F)C(OC)=CC=C4
Tpsa
119.63
Logp
6.7744
H Acceptors
8
H Donors
2
Rotatable Bonds
16
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 2409132-64-3 | 4-[[(1R)-2-[4-(2,2-Dimethyl-4-oxopentyl)-5-(2-fluoro-3-methoxyphenyl)-3-[[2-fluoro-6-(trifluoromethyl)phenyl]methyl]-3,6-dihydro-2,6-dioxo-1(2H)-pyrimidinyl]-1-phenylethyl]amino]butanoic acid | A2B Chem | -- |
SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₈H₄₀F₅N₃O₆
Molecular Weight: 729.73
Synonyms: None
SMILES: C(C(CC(C)=O)(C)C)C1=C(C(=O)N(C[C@H](NCCCC(O)=O)C2=CC=CC=C2)C(=O)N1CC3=C(C(F)(F)F)C=CC=C3F)C4=C(F)C(OC)=CC=C4
Tpsa: 119.63
Logp: 6.7744
H Acceptors: 8
H Donors: 2
Rotatable Bonds: 16
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₈H₄₀F₅N₃O₆
Molecular Weight:
729.73
Synonyms:
None
SMILES:
C(C(CC(C)=O)(C)C)C1=C(C(=O)N(C[C@H](NCCCC(O)=O)C2=CC=CC=C2)C(=O)N1CC3=C(C(F)(F)F)C=CC=C3F)C4=C(F)C(OC)=CC=C4
Tpsa:
119.63
Logp:
6.7744
H Acceptors:
8
H Donors:
2
Rotatable Bonds:
16
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₁H₂₂F₂N₆O₂
Molecular Weight: 428.44
Synonyms: None
SMILES: FC1=C([C@H]2N(CCC2)C3=NC4=C(NC(=O)N5CC[C@H](O)C5)C=NN4C=C3)C=C(F)C=C1
Tpsa: 86
Logp: 2.9475
H Acceptors: 6
H Donors: 2
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₁H₂₂F₂N₆O₂
Molecular Weight:
428.44
Synonyms:
None
SMILES:
FC1=C([C@H]2N(CCC2)C3=NC4=C(NC(=O)N5CC[C@H](O)C5)C=NN4C=C3)C=C(F)C=C1
Tpsa:
86
Logp:
2.9475
H Acceptors:
6
H Donors:
2
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₁H₂₂F₂N₆O₂
Molecular Weight: 428.44
Synonyms: None
SMILES: FC1=C([C@H]2N(CCC2)C3=NC4=C(NC(=O)N5CC[C@@H](O)C5)C=NN4C=C3)C=C(F)C=C1
Tpsa: 86
Logp: 2.9475
H Acceptors: 6
H Donors: 2
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₁H₂₂F₂N₆O₂
Molecular Weight:
428.44
Synonyms:
None
SMILES:
FC1=C([C@H]2N(CCC2)C3=NC4=C(NC(=O)N5CC[C@@H](O)C5)C=NN4C=C3)C=C(F)C=C1
Tpsa:
86
Logp:
2.9475
H Acceptors:
6
H Donors:
2
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₅H₃₀N₆O₈S₃
Molecular Weight: 638.74
Synonyms: None
SMILES: C(OCOC(C(C)(C)C)=O)(=O)C1=C(/C=C\C2=C(C)N=CS2)CS[C@]([C@H](NC(/C(=N\OC)/C=3N=C(N)SC3)=O)C(O)=O)(N1)[H]
Tpsa: 204.42
Logp: 2.13012
H Acceptors: 15
H Donors: 4
Rotatable Bonds: 11
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₅H₃₀N₆O₈S₃
Molecular Weight:
638.74
Synonyms:
None
SMILES:
C(OCOC(C(C)(C)C)=O)(=O)C1=C(/C=C\C2=C(C)N=CS2)CS[C@]([C@H](NC(/C(=N\OC)/C=3N=C(N)SC3)=O)C(O)=O)(N1)[H]
Tpsa:
204.42
Logp:
2.13012
H Acceptors:
15
H Donors:
4
Rotatable Bonds:
11