CS-0914137
Rel-(4S,6R)-6-((E)-2-(3-(4-Fluorophenyl)-1-isopropyl-1H-indol-2-yl)vinyl)-4-hydroxytetrahydro-2H-pyran-2-one
Manufacturer: ChemScene
CAS Number: 93957-56-3
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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
C₂₄H₂₄FNO₃
Molecular Weight
393.45
Synonyms
None
SMILES
C(=C/[C@H]1C[C@H](O)CC(=O)O1)\C2=C(C=3C(N2C(C)C)=CC=CC3)C4=CC=C(F)C=C4
Tpsa
51.46
Logp
5.108
H Acceptors
4
H Donors
1
Rotatable Bonds
4
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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: C₂₄H₂₄FNO₃
Molecular Weight: 393.45
Synonyms: None
SMILES: C(=C/[C@H]1C[C@H](O)CC(=O)O1)\C2=C(C=3C(N2C(C)C)=CC=CC3)C4=CC=C(F)C=C4
Tpsa: 51.46
Logp: 5.108
H Acceptors: 4
H Donors: 1
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:
C₂₄H₂₄FNO₃
Molecular Weight:
393.45
Synonyms:
None
SMILES:
C(=C/[C@H]1C[C@H](O)CC(=O)O1)\C2=C(C=3C(N2C(C)C)=CC=CC3)C4=CC=C(F)C=C4
Tpsa:
51.46
Logp:
5.108
H Acceptors:
4
H Donors:
1
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: C₂₄H₂₆FNO₄
Molecular Weight: 411.47
Synonyms: None
SMILES: C(C)(C)N1C2=C(C=3C(C([C@@H](C[C@@H](CC(O)=O)O)O)(C2)[H])=CC(F)=CC3)C=4C1=CC=CC4
Tpsa: 82.69
Logp: 4.2546
H Acceptors: 4
H Donors: 3
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:
C₂₄H₂₆FNO₄
Molecular Weight:
411.47
Synonyms:
None
SMILES:
C(C)(C)N1C2=C(C=3C(C([C@@H](C[C@@H](CC(O)=O)O)O)(C2)[H])=CC(F)=CC3)C=4C1=CC=CC4
Tpsa:
82.69
Logp:
4.2546
H Acceptors:
4
H Donors:
3
Rotatable Bonds:
6
Purity: 97%
MDL No: MFCD28064102
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₃FN₆O
Molecular Weight: 288.28
Synonyms: None
SMILES: FC=1C=CC=CC1C(O)(CN2N=CN=C2)CN3N=CN=C3
Tpsa: N/A
Logp: N/A
H Acceptors: N/A
H Donors: N/A
Rotatable Bonds: N/A
Purity:
97%
MDL No:
MFCD28064102
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₃FN₆O
Molecular Weight:
288.28
Synonyms:
None
SMILES:
FC=1C=CC=CC1C(O)(CN2N=CN=C2)CN3N=CN=C3
Tpsa:
N/A
Logp:
N/A
H Acceptors:
N/A
H Donors:
N/A
Rotatable Bonds:
N/A
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₇NNaO₆S
Molecular Weight: 326.32
Synonyms: None
SMILES: [C@H]([C@@H](C)O)(C(O)=O)[C@@]1(N=C(C(O)=O)\C(=C\CCCO)\S1)[H].[Na]
Tpsa: 127.42
Logp: -0.0579
H Acceptors: 6
H Donors: 4
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:
C₁₂H₁₇NNaO₆S
Molecular Weight:
326.32
Synonyms:
None
SMILES:
[C@H]([C@@H](C)O)(C(O)=O)[C@@]1(N=C(C(O)=O)\C(=C\CCCO)\S1)[H].[Na]
Tpsa:
127.42
Logp:
-0.0579
H Acceptors:
6
H Donors:
4
Rotatable Bonds:
7