CS-0654193
[S(S)]-N-[(1S)-1-(4-Cyano-3-fluorophenyl)ethyl]-2-methyl-2-propanesulfinamide
Manufacturer: ChemScene
CAS Number: 2813339-49-8
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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
C₁₃H₁₇FN₂OS
Molecular Weight
268.35
Synonyms
None
SMILES
CC([S@@](N[C@H](C1=CC=C(C#N)C(F)=C1)C)=O)(C)C
Tpsa
52.89
Logp
2.81018
H Acceptors
2
H Donors
1
Rotatable Bonds
3
Related Products
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: C₁₃H₁₇FN₂OS
Molecular Weight: 268.35
Synonyms: None
SMILES: CC([S@@](N[C@H](C1=CC=C(C#N)C(F)=C1)C)=O)(C)C
Tpsa: 52.89
Logp: 2.81018
H Acceptors: 2
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:
C₁₃H₁₇FN₂OS
Molecular Weight:
268.35
Synonyms:
None
SMILES:
CC([S@@](N[C@H](C1=CC=C(C#N)C(F)=C1)C)=O)(C)C
Tpsa:
52.89
Logp:
2.81018
H Acceptors:
2
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: C₆H₁₃NO₂S
Molecular Weight: 163.24
Synonyms: None
SMILES: C=CCCCCS(=O)(N)=O
Tpsa: 60.16
Logp: 0.6312
H Acceptors: 2
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:
C₆H₁₃NO₂S
Molecular Weight:
163.24
Synonyms:
None
SMILES:
C=CCCCCS(=O)(N)=O
Tpsa:
60.16
Logp:
0.6312
H Acceptors:
2
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: C₇H₁₁ClN₂
Molecular Weight: 158.63
Synonyms: methyl-pyridin-4-ylmethyl-amine (hydrochloride)
SMILES: NC(C)C1=CC=NC=C1.Cl
Tpsa: 38.91
Logp: 1.5231
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₁₁ClN₂
Molecular Weight:
158.63
Synonyms:
methyl-pyridin-4-ylmethyl-amine (hydrochloride)
SMILES:
NC(C)C1=CC=NC=C1.Cl
Tpsa:
38.91
Logp:
1.5231
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₆F₃N₃O
Molecular Weight: 193.13
Synonyms: None
SMILES: O=C1NC(N)=NC(C(F)(F)F)=C1C
Tpsa: 71.77
Logp: 0.67932
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₆F₃N₃O
Molecular Weight:
193.13
Synonyms:
None
SMILES:
O=C1NC(N)=NC(C(F)(F)F)=C1C
Tpsa:
71.77
Logp:
0.67932
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
0