CS-0915139
Elagolix Impurity 7
Manufacturer: ChemScene
CAS Number: 126610-77-3
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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
C₂₀H₂₅NO₅S
Molecular Weight
391.48
Synonyms
None
SMILES
[C@@H](COS(=O)(=O)C1=CC=C(C)C=C1)(NC(OC(C)(C)C)=O)C2=CC=CC=C2
Tpsa
81.7
Logp
3.96632
H Acceptors
5
H Donors
1
Rotatable Bonds
6
Related Products
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: C₂₀H₂₅NO₅S
Molecular Weight: 391.48
Synonyms: None
SMILES: [C@@H](COS(=O)(=O)C1=CC=C(C)C=C1)(NC(OC(C)(C)C)=O)C2=CC=CC=C2
Tpsa: 81.7
Logp: 3.96632
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₂₅NO₅S
Molecular Weight:
391.48
Synonyms:
None
SMILES:
[C@@H](COS(=O)(=O)C1=CC=C(C)C=C1)(NC(OC(C)(C)C)=O)C2=CC=CC=C2
Tpsa:
81.7
Logp:
3.96632
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₂H₃₀F₅N₃O₆
Molecular Weight: 647.59
Synonyms: None
SMILES: CC1=C(C(=O)N(C[C@H](N(CCCC(O)=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: 114
Logp: 5.63662
H Acceptors: 8
H Donors: 2
Rotatable Bonds: 12
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₂H₃₀F₅N₃O₆
Molecular Weight:
647.59
Synonyms:
None
SMILES:
CC1=C(C(=O)N(C[C@H](N(CCCC(O)=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:
114
Logp:
5.63662
H Acceptors:
8
H Donors:
2
Rotatable Bonds:
12
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₇H₂₂F₅N₃O₃
Molecular Weight: 531.47
Synonyms: None
SMILES: CC1=C(C(=O)N(C[C@H](N)C2=CC=CC=C2)C(=O)N1CC3=C(C(F)(F)F)C=CC=C3F)C4=C(F)C(O)=CC=C4
Tpsa: 90.25
Logp: 4.73632
H Acceptors: 6
H Donors: 2
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₇H₂₂F₅N₃O₃
Molecular Weight:
531.47
Synonyms:
None
SMILES:
CC1=C(C(=O)N(C[C@H](N)C2=CC=CC=C2)C(=O)N1CC3=C(C(F)(F)F)C=CC=C3F)C4=C(F)C(O)=CC=C4
Tpsa:
90.25
Logp:
4.73632
H Acceptors:
6
H Donors:
2
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₂H₃₀F₅N₃O₅
Molecular Weight: 631.59
Synonyms: None
SMILES: CC1=C(C(=O)N(C[C@H](NC(OC(C)(C)C)=O)C2=CC=CC=C2)C(=O)N1CC3=C(C(F)(F)F)C=CC=C3F)C4=C(F)C(O)=CC=C4
Tpsa: 102.56
Logp: 6.30232
H Acceptors: 7
H Donors: 2
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₂H₃₀F₅N₃O₅
Molecular Weight:
631.59
Synonyms:
None
SMILES:
CC1=C(C(=O)N(C[C@H](NC(OC(C)(C)C)=O)C2=CC=CC=C2)C(=O)N1CC3=C(C(F)(F)F)C=CC=C3F)C4=C(F)C(O)=CC=C4
Tpsa:
102.56
Logp:
6.30232
H Acceptors:
7
H Donors:
2
Rotatable Bonds:
7