CS-1002118
Enzalutamide Impurity 45
Manufacturer: ChemScene
CAS Number: 1798807-39-2
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Purity
95%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₇H₁₂F₄N₄OS
Molecular Weight
396.36
Synonyms
None
SMILES
N#CC1=CC=C(C=C1C(F)(F)F)NC(=S)NC2=CC=C(C(F)=C2)C(=O)NC
Tpsa
76.95
Logp
3.88468
H Acceptors
3
H Donors
3
Rotatable Bonds
3
Related Products
SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
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: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₇H₁₂F₄N₄OS
Molecular Weight: 396.36
Synonyms: None
SMILES: N#CC1=CC=C(C=C1C(F)(F)F)NC(=S)NC2=CC=C(C(F)=C2)C(=O)NC
Tpsa: 76.95
Logp: 3.88468
H Acceptors: 3
H Donors: 3
Rotatable Bonds: 3
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₇H₁₂F₄N₄OS
Molecular Weight:
396.36
Synonyms:
None
SMILES:
N#CC1=CC=C(C=C1C(F)(F)F)NC(=S)NC2=CC=C(C(F)=C2)C(=O)NC
Tpsa:
76.95
Logp:
3.88468
H Acceptors:
3
H Donors:
3
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: C₁₆H₂₅NO₄
Molecular Weight: 295.37
Synonyms: None
SMILES: C(C(OC(C)(C)C)=O)[C@@]1(CN(=O)=O)[C@]2([C@@](C1)(CC(CC)=C2)[H])[H]
Tpsa: 69.44
Logp: 3.3575
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₂₅NO₄
Molecular Weight:
295.37
Synonyms:
None
SMILES:
C(C(OC(C)(C)C)=O)[C@@]1(CN(=O)=O)[C@]2([C@@](C1)(CC(CC)=C2)[H])[H]
Tpsa:
69.44
Logp:
3.3575
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₇H₃₂N₂O₇
Molecular Weight: 496.55
Synonyms: None
SMILES: C(CC(O)=O)C(O)=O.O(C(N(C(=O)C1=CC=CC=C1)CCC2=CC=CC=C2)=O)[C@H]3N4CCC(C3)CC4
Tpsa: 124.45
Logp: 3.8857
H Acceptors: 6
H Donors: 2
Rotatable Bonds: 8
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₇H₃₂N₂O₇
Molecular Weight:
496.55
Synonyms:
None
SMILES:
C(CC(O)=O)C(O)=O.O(C(N(C(=O)C1=CC=CC=C1)CCC2=CC=CC=C2)=O)[C@H]3N4CCC(C3)CC4
Tpsa:
124.45
Logp:
3.8857
H Acceptors:
6
H Donors:
2
Rotatable Bonds:
8
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅H₂₄N₆O₄
Molecular Weight: 352.39
Synonyms: None
SMILES: C(OCCOC([C@H](NCC)C(C)C)=O)N1C2=C(N=C1)C(=O)N=C(N)N2
Tpsa: 137.15
Logp: -0.1468
H Acceptors: 9
H Donors: 3
Rotatable Bonds: 9
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₂₄N₆O₄
Molecular Weight:
352.39
Synonyms:
None
SMILES:
C(OCCOC([C@H](NCC)C(C)C)=O)N1C2=C(N=C1)C(=O)N=C(N)N2
Tpsa:
137.15
Logp:
-0.1468
H Acceptors:
9
H Donors:
3
Rotatable Bonds:
9