CS-0536291

N-((4-(5-methyl-4-phenylisoxazol-3-yl)phenyl)sulfonyl)propionamide

Manufacturer: ChemScene

CAS Number: 2235371-89-6

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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

C₁₉H₁₈N₂O₄S

Molecular Weight

370.42

Synonyms

Parecoxib Sodium-19

SMILES

O=C(NS(=O)(=O)C=1C=CC(=CC1)C2=NOC(=C2C=3C=CC=CC3)C)CC

Tpsa

89.27

Logp

3.53192

H Acceptors

5

H Donors

1

Rotatable Bonds

5

SAFETY INFORMATION

Pictograms

GHS07

Signal Word

Warning

UN Number

N/A

Class

N/A

Packing Group

N/A

Hazard Statements

H302-H315-H319-H335

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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Img

ChemScene

CS-0536291

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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:
C₁₉H₁₈N₂O₄S

Molecular Weight:
370.42

Synonyms:
Parecoxib Sodium-19

SMILES:
O=C(NS(=O)(=O)C=1C=CC(=CC1)C2=NOC(=C2C=3C=CC=CC3)C)CC

Tpsa:
89.27

Logp:
3.53192

H Acceptors:
5

H Donors:
1

Rotatable Bonds:
5

Img

ChemScene

CS-0536292

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Purity:
96%

MDL No:
None

Storage:
4°C, stored under nitrogen

Shipping:
Room temperature in continental US; may vary elsewhere.

Molecular Formula:
C₁₁H₁₁ClN₂O₂

Molecular Weight:
238.67

Synonyms:
3-(2-Chloroethyl)-2-methyl-9-hydroxy-4H-pyrido[1,2-a]pyrimidin-4-one (Paliperidone)

SMILES:
CC1=C(C(=O)N2C=CC=C(C2=N1)O)CCCl

Tpsa:
54.6

Logp:
1.48982

H Acceptors:
4

H Donors:
1

Rotatable Bonds:
2

Img

ChemScene

CS-0536293

--


Purity:
98%

MDL No:
None

Storage:
Sealed in dry,2-8℃

Shipping:
Room temperature in continental US; may vary elsewhere.

Molecular Formula:
C₁₄H₁₈N₂O₄

Molecular Weight:
278.30

Synonyms:
None

SMILES:
O=C1N(C[C@H](CO)O1)C2=CC=C(C=C2)N3CCOCC3

Tpsa:
62.24

Logp:
0.8407

H Acceptors:
5

H Donors:
1

Rotatable Bonds:
3

Img

ChemScene

CS-0536294

--


Purity:
98%

MDL No:
None

Storage:
Sealed in dry,2-8℃

Shipping:
Room temperature in continental US; may vary elsewhere.

Molecular Formula:
C₁₅H₂₀N₂O₆S

Molecular Weight:
356.39

Synonyms:
None

SMILES:
O=C1N(C[C@H](COS(C)(=O)=O)O1)C2=CC=C(C=C2)N3CCOCC3

Tpsa:
85.38

Logp:
0.8246

H Acceptors:
7

H Donors:
0

Rotatable Bonds:
5