CS-1005215
Imrecoxib Impurity 1
Manufacturer: ChemScene
CAS Number: 896729-07-0
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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
C₂₁H₂₃NO₄S
Molecular Weight
385.48
Synonyms
None
SMILES
O=C1C(C2=CC=C(C=C2)CO)=C(C=3C=CC(=CC3)S(=O)(=O)C)CN1CCC
Tpsa
74.68
Logp
2.7454
H Acceptors
4
H Donors
1
Rotatable Bonds
6
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 896729-07-0 | | A2B Chem | -- |
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: C₂₁H₂₃NO₄S
Molecular Weight: 385.48
Synonyms: None
SMILES: O=C1C(C2=CC=C(C=C2)CO)=C(C=3C=CC(=CC3)S(=O)(=O)C)CN1CCC
Tpsa: 74.68
Logp: 2.7454
H Acceptors: 4
H Donors: 1
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:
C₂₁H₂₃NO₄S
Molecular Weight:
385.48
Synonyms:
None
SMILES:
O=C1C(C2=CC=C(C=C2)CO)=C(C=3C=CC(=CC3)S(=O)(=O)C)CN1CCC
Tpsa:
74.68
Logp:
2.7454
H Acceptors:
4
H Donors:
1
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: C₁₀H₁₅NO₅S₃
Molecular Weight: 325.42
Synonyms: None
SMILES: O=S1(=O)C2=C([C@@H](NCC)C[C@@H]1C)C=C(S(=O)(=O)O)S2
Tpsa: 100.54
Logp: 1.2113
H Acceptors: 6
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:
C₁₀H₁₅NO₅S₃
Molecular Weight:
325.42
Synonyms:
None
SMILES:
O=S1(=O)C2=C([C@@H](NCC)C[C@@H]1C)C=C(S(=O)(=O)O)S2
Tpsa:
100.54
Logp:
1.2113
H Acceptors:
6
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: C₃H₆N₄O₃
Molecular Weight: 146.10
Synonyms: None
SMILES: O=C(O)C(=O)NNC(=N)N
Tpsa: 128.3
Logp: -2.41473
H Acceptors: 3
H Donors: 5
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:
C₃H₆N₄O₃
Molecular Weight:
146.10
Synonyms:
None
SMILES:
O=C(O)C(=O)NNC(=N)N
Tpsa:
128.3
Logp:
-2.41473
H Acceptors:
3
H Donors:
5
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: C₈H₉ClN₂S
Molecular Weight: 200.69
Synonyms: None
SMILES: ClC1=CC=CC(=C1)CSC(=N)N
Tpsa: 49.87
Logp: 2.46667
H Acceptors: 2
H Donors: 2
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:
C₈H₉ClN₂S
Molecular Weight:
200.69
Synonyms:
None
SMILES:
ClC1=CC=CC(=C1)CSC(=N)N
Tpsa:
49.87
Logp:
2.46667
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
2