CS-0569783
Calcium (3R,5S,E)-7-(2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl)-3,5-dihydroxyhept-6-enoate
Manufacturer: ChemScene
CAS Number: 47526-32-7
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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
C₅₀H₄₆CaF₂N₂O₈
Molecular Weight
880.98
Synonyms
None
SMILES
O=C(C[C@@H](C[C@@H](/C=C/C1=C(C2=CC=CC=C2N=C1C3CC3)C4=CC=C(C=C4)F)O)O)[O-].O=C(C[C@@H](C[C@@H](/C=C/C5=C(C6=CC=CC=C6N=C5C7CC7)C8=CC=C(C=C8)F)O)O)[O-].[Ca+2]
Tpsa
186.96
Logp
5.986
H Acceptors
10
H Donors
4
Rotatable Bonds
16
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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-P330-P362+P364-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: C₅₀H₄₆CaF₂N₂O₈
Molecular Weight: 880.98
Synonyms: None
SMILES: O=C(C[C@@H](C[C@@H](/C=C/C1=C(C2=CC=CC=C2N=C1C3CC3)C4=CC=C(C=C4)F)O)O)[O-].O=C(C[C@@H](C[C@@H](/C=C/C5=C(C6=CC=CC=C6N=C5C7CC7)C8=CC=C(C=C8)F)O)O)[O-].[Ca+2]
Tpsa: 186.96
Logp: 5.986
H Acceptors: 10
H Donors: 4
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:
C₅₀H₄₆CaF₂N₂O₈
Molecular Weight:
880.98
Synonyms:
None
SMILES:
O=C(C[C@@H](C[C@@H](/C=C/C1=C(C2=CC=CC=C2N=C1C3CC3)C4=CC=C(C=C4)F)O)O)[O-].O=C(C[C@@H](C[C@@H](/C=C/C5=C(C6=CC=CC=C6N=C5C7CC7)C8=CC=C(C=C8)F)O)O)[O-].[Ca+2]
Tpsa:
186.96
Logp:
5.986
H Acceptors:
10
H Donors:
4
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: C₂₉H₄₆OS₂
Molecular Weight: 474.80
Synonyms: None
SMILES: CC(C)CCCCC(C)CC1(CC(C)CCCCC(C)C)OC2=C(SC=C2)C3=C1C=CS3
Tpsa: 9.23
Logp: 10.5495
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 14
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₉H₄₆OS₂
Molecular Weight:
474.80
Synonyms:
None
SMILES:
CC(C)CCCCC(C)CC1(CC(C)CCCCC(C)C)OC2=C(SC=C2)C3=C1C=CS3
Tpsa:
9.23
Logp:
10.5495
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
14
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₇H₂₇BO₄
Molecular Weight: 306.20
Synonyms: None
SMILES: CC1(C)C(C)(C)OB(C2=CC(OC)=C(C(C)C)C(OC)=C2)O1
Tpsa: 36.92
Logp: 3.1264
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₇H₂₇BO₄
Molecular Weight:
306.20
Synonyms:
None
SMILES:
CC1(C)C(C)(C)OB(C2=CC(OC)=C(C(C)C)C(OC)=C2)O1
Tpsa:
36.92
Logp:
3.1264
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₈H₃₂S
Molecular Weight: 280.51
Synonyms: IN1448, 2-(2-Ethylhexyl)-3-hexylthiophene
SMILES: CCCCCCC1=C(CC(CC)CCCC)SC=C1
Tpsa: 0
Logp: 6.6298
H Acceptors: 1
H Donors: 0
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:
C₁₈H₃₂S
Molecular Weight:
280.51
Synonyms:
IN1448, 2-(2-Ethylhexyl)-3-hexylthiophene
SMILES:
CCCCCCC1=C(CC(CC)CCCC)SC=C1
Tpsa:
0
Logp:
6.6298
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
11