CS-0915142
Elagolix Impurity 27
Manufacturer: ChemScene
CAS Number: 1062642-68-5
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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
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
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 1062642-68-5 | | A2B Chem | -- |
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: 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
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₈H₂₂F₅N₃O₄
Molecular Weight: 559.48
Synonyms: None
SMILES: O=C1C(C=2C=CC=C(OC)C2F)=C(N(C(=O)N1CC(=NO)C=3C=CC=CC3)CC=4C(F)=CC=CC4C(F)(F)F)C
Tpsa: 85.82
Logp: 5.21782
H Acceptors: 7
H Donors: 1
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:
C₂₈H₂₂F₅N₃O₄
Molecular Weight:
559.48
Synonyms:
None
SMILES:
O=C1C(C=2C=CC=C(OC)C2F)=C(N(C(=O)N1CC(=NO)C=3C=CC=CC3)CC=4C(F)=CC=CC4C(F)(F)F)C
Tpsa:
85.82
Logp:
5.21782
H Acceptors:
7
H Donors:
1
Rotatable Bonds:
7
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₈H₂₄F₅N₃O₄
Molecular Weight: 561.50
Synonyms: None
SMILES: CC1=C(C(=O)N(C[C@H](NO)C2=CC=CC=C2)C(=O)N1CC3=C(C(F)(F)F)C=CC=C3F)C4=C(F)C(OC)=CC=C4
Tpsa: 85.49
Logp: 5.05942
H Acceptors: 7
H Donors: 2
Rotatable Bonds: 8
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₈H₂₄F₅N₃O₄
Molecular Weight:
561.50
Synonyms:
None
SMILES:
CC1=C(C(=O)N(C[C@H](NO)C2=CC=CC=C2)C(=O)N1CC3=C(C(F)(F)F)C=CC=C3F)C4=C(F)C(OC)=CC=C4
Tpsa:
85.49
Logp:
5.05942
H Acceptors:
7
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: C₁₃H₉ClF₄N₂O₂
Molecular Weight: 336.67
Synonyms: None
SMILES: O=C1NC(=O)N(C(=C1Cl)C)CC=2C(F)=CC=CC2C(F)(F)F
Tpsa: 54.86
Logp: 2.70462
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₉ClF₄N₂O₂
Molecular Weight:
336.67
Synonyms:
None
SMILES:
O=C1NC(=O)N(C(=C1Cl)C)CC=2C(F)=CC=CC2C(F)(F)F
Tpsa:
54.86
Logp:
2.70462
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2