CS-0536346
4-(5-Hydroxy-3-(p-tolyl)-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl)benzenesulfonamide
Manufacturer: ChemScene
CAS Number: 1803258-57-2
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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
C₁₇H₁₆F₃N₃O₃S
Molecular Weight
399.39
Synonyms
None
SMILES
O=S(C1=CC=C(N2N=C(C3=CC=C(C)C=C3)CC2(O)C(F)(F)F)C=C1)(N)=O
Tpsa
95.99
Logp
2.50772
H Acceptors
5
H Donors
2
Rotatable Bonds
3
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: C₁₇H₁₆F₃N₃O₃S
Molecular Weight: 399.39
Synonyms: None
SMILES: O=S(C1=CC=C(N2N=C(C3=CC=C(C)C=C3)CC2(O)C(F)(F)F)C=C1)(N)=O
Tpsa: 95.99
Logp: 2.50772
H Acceptors: 5
H Donors: 2
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:
C₁₇H₁₆F₃N₃O₃S
Molecular Weight:
399.39
Synonyms:
None
SMILES:
O=S(C1=CC=C(N2N=C(C3=CC=C(C)C=C3)CC2(O)C(F)(F)F)C=C1)(N)=O
Tpsa:
95.99
Logp:
2.50772
H Acceptors:
5
H Donors:
2
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: C₃₂H₃₈N₆O₄S₂
Molecular Weight: 634.81
Synonyms: lurasidone-16
SMILES: O=C(N1CCN(C2=NSC3=CC=CC=C23)CC1)OC[C@H]4[C@H](COC(N5CCN(C6=NSC7=CC=CC=C67)CC5)=O)CCCC4
Tpsa: 91.34
Logp: 5.9298
H Acceptors: 10
H Donors: 0
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:
C₃₂H₃₈N₆O₄S₂
Molecular Weight:
634.81
Synonyms:
lurasidone-16
SMILES:
O=C(N1CCN(C2=NSC3=CC=CC=C23)CC1)OC[C@H]4[C@H](COC(N5CCN(C6=NSC7=CC=CC=C67)CC5)=O)CCCC4
Tpsa:
91.34
Logp:
5.9298
H Acceptors:
10
H Donors:
0
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: C₁₆H₁₄N₂O₃S
Molecular Weight: 314.36
Synonyms: 4-(3-methyl-4-phenylisoxazol-5-yl)benzenesulfonamide
SMILES: CC1=NOC(=C1C2=CC=C(C=C2)S(=O)(=O)N)C3=CC=CC=C3
Tpsa: 86.19
Logp: 2.96442
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:
C₁₆H₁₄N₂O₃S
Molecular Weight:
314.36
Synonyms:
4-(3-methyl-4-phenylisoxazol-5-yl)benzenesulfonamide
SMILES:
CC1=NOC(=C1C2=CC=C(C=C2)S(=O)(=O)N)C3=CC=CC=C3
Tpsa:
86.19
Logp:
2.96442
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: C₁₆H₁₄N₂O₃S
Molecular Weight: 314.36
Synonyms: Parecoxib Sodium-10
SMILES: CC1=C(C(=NO1)C2=CC=C(C=C2)S(=O)(=O)N)C3=CC=CC=C3
Tpsa: 86.19
Logp: 2.96442
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:
C₁₆H₁₄N₂O₃S
Molecular Weight:
314.36
Synonyms:
Parecoxib Sodium-10
SMILES:
CC1=C(C(=NO1)C2=CC=C(C=C2)S(=O)(=O)N)C3=CC=CC=C3
Tpsa:
86.19
Logp:
2.96442
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
3