CS-0134570
(3R,5R)-1-(tert-Butylsulfonyl)-5-(2,5-difluorophenyl)pyrrolidin-3-ol compound with (3S,5R)-1-(tert-butylsulfonyl)-5-(2,5-difluorophenyl)pyrrolidin-3-ol 1:1
Manufacturer: ChemScene
CAS Number: None
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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
C₂₈H₃₈F₄N₂O₆S₂
Molecular Weight
638.73
Synonyms
None
SMILES
O[C@H]1CN(S(=O)(C(C)(C)C)=O)[C@@H](C2=CC(F)=CC=C2F)C1.O[C@@H]3CN(S(=O)(C(C)(C)C)=O)[C@@H](C4=CC(F)=CC=C4F)C3
Tpsa
115.22
Logp
4.4016
H Acceptors
6
H Donors
2
Rotatable Bonds
4
Other Options
...
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: C₂₈H₃₈F₄N₂O₆S₂
Molecular Weight: 638.73
Synonyms: None
SMILES: O[C@H]1CN(S(=O)(C(C)(C)C)=O)[C@@H](C2=CC(F)=CC=C2F)C1.O[C@@H]3CN(S(=O)(C(C)(C)C)=O)[C@@H](C4=CC(F)=CC=C4F)C3
Tpsa: 115.22
Logp: 4.4016
H Acceptors: 6
H Donors: 2
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:
C₂₈H₃₈F₄N₂O₆S₂
Molecular Weight:
638.73
Synonyms:
None
SMILES:
O[C@H]1CN(S(=O)(C(C)(C)C)=O)[C@@H](C2=CC(F)=CC=C2F)C1.O[C@@H]3CN(S(=O)(C(C)(C)C)=O)[C@@H](C4=CC(F)=CC=C4F)C3
Tpsa:
115.22
Logp:
4.4016
H Acceptors:
6
H Donors:
2
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Store at room temperature
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₉F₂NO₃S
Molecular Weight: 319.37
Synonyms: None
SMILES: O[C@H]1CN(S(=O)(C(C)(C)C)=O)[C@@H](C2=CC(F)=CC=C2F)C1
Tpsa: 57.61
Logp: 2.2008
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Store at room temperature
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₉F₂NO₃S
Molecular Weight:
319.37
Synonyms:
None
SMILES:
O[C@H]1CN(S(=O)(C(C)(C)C)=O)[C@@H](C2=CC(F)=CC=C2F)C1
Tpsa:
57.61
Logp:
2.2008
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: C₁₁H₁₃F₂NOS
Molecular Weight: 245.29
Synonyms: None
SMILES: FC1=CC(/C=N/[S@](C(C)(C)C)=O)=C(C=C1)F
Tpsa: 29.43
Logp: 2.8459
H Acceptors: 1
H Donors: 0
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:
C₁₁H₁₃F₂NOS
Molecular Weight:
245.29
Synonyms:
None
SMILES:
FC1=CC(/C=N/[S@](C(C)(C)C)=O)=C(C=C1)F
Tpsa:
29.43
Logp:
2.8459
H Acceptors:
1
H Donors:
0
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: C₁₄H₁₉F₂NOS
Molecular Weight: 287.37
Synonyms: None
SMILES: CC([S@](N[C@@H](CC=C)C1=C(C=CC(F)=C1)F)=O)(C)C
Tpsa: 29.1
Logp: 3.6338
H Acceptors: 1
H Donors: 1
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:
C₁₄H₁₉F₂NOS
Molecular Weight:
287.37
Synonyms:
None
SMILES:
CC([S@](N[C@@H](CC=C)C1=C(C=CC(F)=C1)F)=O)(C)C
Tpsa:
29.1
Logp:
3.6338
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
5