CS-0655245
(2S,3S)-3-(2,5-Difluorophenyl)-3-hydroxy-2-methyl-4-(1H-1,2,4-triazol-1-yl)butanethioamide
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
C₁₃H₁₄F₂N₄OS
Molecular Weight
312.34
Synonyms
None
SMILES
C[C@@H]([C@](CN1N=CN=C1)(O)C2=CC(F)=CC=C2F)C(N)=S
Tpsa
76.96
Logp
1.3663
H Acceptors
5
H Donors
2
Rotatable Bonds
5
Other Options
...
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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: C₁₃H₁₄F₂N₄OS
Molecular Weight: 312.34
Synonyms: None
SMILES: C[C@@H]([C@](CN1N=CN=C1)(O)C2=CC(F)=CC=C2F)C(N)=S
Tpsa: 76.96
Logp: 1.3663
H Acceptors: 5
H Donors: 2
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:
C₁₃H₁₄F₂N₄OS
Molecular Weight:
312.34
Synonyms:
None
SMILES:
C[C@@H]([C@](CN1N=CN=C1)(O)C2=CC(F)=CC=C2F)C(N)=S
Tpsa:
76.96
Logp:
1.3663
H Acceptors:
5
H Donors:
2
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: 4°C, protect from light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₅H₇BrN₂S
Molecular Weight: 207.09
Synonyms: None
SMILES: NCCC1=NC=C(Br)S1
Tpsa: 38.91
Logp: 1.4068
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
4°C, protect from light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅H₇BrN₂S
Molecular Weight:
207.09
Synonyms:
None
SMILES:
NCCC1=NC=C(Br)S1
Tpsa:
38.91
Logp:
1.4068
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: C₁₀H₁₅BrN₂O₂S
Molecular Weight: 307.21
Synonyms: None
SMILES: O=C(OC(C)(C)C)NCCC1=NC=C(Br)S1
Tpsa: 51.22
Logp: 2.9728
H Acceptors: 4
H Donors: 1
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:
C₁₀H₁₅BrN₂O₂S
Molecular Weight:
307.21
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)NCCC1=NC=C(Br)S1
Tpsa:
51.22
Logp:
2.9728
H Acceptors:
4
H Donors:
1
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: C₁₂H₂₁NO₄
Molecular Weight: 243.30
Synonyms: None
SMILES: C[C@H](OC1CCCCO1)C(N2CCOCC2)=O
Tpsa: 48
Logp: 0.7769
H Acceptors: 4
H Donors: 0
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:
C₁₂H₂₁NO₄
Molecular Weight:
243.30
Synonyms:
None
SMILES:
C[C@H](OC1CCCCO1)C(N2CCOCC2)=O
Tpsa:
48
Logp:
0.7769
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
3