CS-0655042
((3R,5S)-5-((1H-1,2,4-Triazol-1-yl)methyl)-5-(2,4-difluorophenyl)tetrahydrofuran-3-yl)methyl 4-chlorobenzenesulfonate
Manufacturer: ChemScene
CAS Number: 2423024-27-3
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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
C₂₀H₁₈ClF₂N₃O₄S
Molecular Weight
469.89
Synonyms
None
SMILES
O=S(OC[C@@H](CO1)C[C@]1(C2=C(C=C(C=C2)F)F)CN3C=NC=N3)(C4=CC=C(C=C4)Cl)=O
Tpsa
83.31
Logp
3.5472
H Acceptors
7
H Donors
0
Rotatable Bonds
7
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: C₂₀H₁₈ClF₂N₃O₄S
Molecular Weight: 469.89
Synonyms: None
SMILES: O=S(OC[C@@H](CO1)C[C@]1(C2=C(C=C(C=C2)F)F)CN3C=NC=N3)(C4=CC=C(C=C4)Cl)=O
Tpsa: 83.31
Logp: 3.5472
H Acceptors: 7
H Donors: 0
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:
C₂₀H₁₈ClF₂N₃O₄S
Molecular Weight:
469.89
Synonyms:
None
SMILES:
O=S(OC[C@@H](CO1)C[C@]1(C2=C(C=C(C=C2)F)F)CN3C=NC=N3)(C4=CC=C(C=C4)Cl)=O
Tpsa:
83.31
Logp:
3.5472
H Acceptors:
7
H Donors:
0
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: C₂₃H₃₈O₇Si
Molecular Weight: 454.63
Synonyms: None
SMILES: CC(C)(C)[Si](C)(C)OCCCO[C@@H]1[C@@]2([H])[C@](CO[C@@H](C3=CC=CC=C3)O2)([H])O[C@@H]([C@H]1O)OC
Tpsa: 75.61
Logp: 3.6299
H Acceptors: 7
H Donors: 1
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:
C₂₃H₃₈O₇Si
Molecular Weight:
454.63
Synonyms:
None
SMILES:
CC(C)(C)[Si](C)(C)OCCCO[C@@H]1[C@@]2([H])[C@](CO[C@@H](C3=CC=CC=C3)O2)([H])O[C@@H]([C@H]1O)OC
Tpsa:
75.61
Logp:
3.6299
H Acceptors:
7
H Donors:
1
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: C₂₁H₂₁F₂N₃O₄S
Molecular Weight: 449.47
Synonyms: None
SMILES: FC(C=C(F)C=C1)=C1[C@]2(CN3C=NC=N3)C[C@H](COS(C4=CC=C(C)C=C4)(=O)=O)CO2
Tpsa: 83.31
Logp: 3.20222
H Acceptors: 7
H Donors: 0
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:
C₂₁H₂₁F₂N₃O₄S
Molecular Weight:
449.47
Synonyms:
None
SMILES:
FC(C=C(F)C=C1)=C1[C@]2(CN3C=NC=N3)C[C@H](COS(C4=CC=C(C)C=C4)(=O)=O)CO2
Tpsa:
83.31
Logp:
3.20222
H Acceptors:
7
H Donors:
0
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: C₁₁H₁₆ClNO₄
Molecular Weight: 261.70
Synonyms: None
SMILES: COC([C@@](C)(N)CC1=CC(O)=C(C=C1)O)=O.Cl
Tpsa: 92.78
Logp: 0.9525
H Acceptors: 5
H Donors: 3
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₆ClNO₄
Molecular Weight:
261.70
Synonyms:
None
SMILES:
COC([C@@](C)(N)CC1=CC(O)=C(C=C1)O)=O.Cl
Tpsa:
92.78
Logp:
0.9525
H Acceptors:
5
H Donors:
3
Rotatable Bonds:
3