CS-1003206
Apremilast Impurity 106
Manufacturer: ChemScene
CAS Number: 253168-80-8
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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
C₂₀H₂₀N₂O₈S
Molecular Weight
448.45
Synonyms
None
SMILES
O=C1C2=CC=C(C=C2C(=O)N1C(C3=CC=C(OC)C(OCC)=C3)CS(=O)(=O)C)N(=O)=O
Tpsa
133.12
Logp
2.384
H Acceptors
8
H Donors
0
Rotatable Bonds
8
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: C₂₀H₂₀N₂O₈S
Molecular Weight: 448.45
Synonyms: None
SMILES: O=C1C2=CC=C(C=C2C(=O)N1C(C3=CC=C(OC)C(OCC)=C3)CS(=O)(=O)C)N(=O)=O
Tpsa: 133.12
Logp: 2.384
H Acceptors: 8
H Donors: 0
Rotatable Bonds: 8
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₂₀N₂O₈S
Molecular Weight:
448.45
Synonyms:
None
SMILES:
O=C1C2=CC=C(C=C2C(=O)N1C(C3=CC=C(OC)C(OCC)=C3)CS(=O)(=O)C)N(=O)=O
Tpsa:
133.12
Logp:
2.384
H Acceptors:
8
H Donors:
0
Rotatable Bonds:
8
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₂₃O₃P
Molecular Weight: 234.27
Synonyms: None
SMILES: O(P(OC(C)(C)C)(/C=C\C)=O)C(C)(C)C
Tpsa: 35.53
Logp: 4.3433
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 3
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₂₃O₃P
Molecular Weight:
234.27
Synonyms:
None
SMILES:
O(P(OC(C)(C)C)(/C=C\C)=O)C(C)(C)C
Tpsa:
35.53
Logp:
4.3433
H Acceptors:
3
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: C₄₇H₅₂N₈O₆
Molecular Weight: 824.97
Synonyms: None
SMILES: C([C@@H](NC(OC)=O)C(C)C)(=O)N1[C@H](C=2NC=3C4=C(C=C5C(=C4)OCC=6C5=CC=C(C6)C=7NC(=NC7)[C@H]8N(C([C@H](N)C9=CC=CC=C9)=O)C[C@@H](COC)C8)C=CC3N2)CC[C@@H]1C
Tpsa: 180.79
Logp: 7.3342
H Acceptors: 9
H Donors: 4
Rotatable Bonds: 10
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₄₇H₅₂N₈O₆
Molecular Weight:
824.97
Synonyms:
None
SMILES:
C([C@@H](NC(OC)=O)C(C)C)(=O)N1[C@H](C=2NC=3C4=C(C=C5C(=C4)OCC=6C5=CC=C(C6)C=7NC(=NC7)[C@H]8N(C([C@H](N)C9=CC=CC=C9)=O)C[C@@H](COC)C8)C=CC3N2)CC[C@@H]1C
Tpsa:
180.79
Logp:
7.3342
H Acceptors:
9
H Donors:
4
Rotatable Bonds:
10
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₂H₂₀F₂N₄O₂
Molecular Weight: 410.42
Synonyms: None
SMILES: C(NC1=CC=C(F)C=N1)(=O)[C@@]2([C@H](COC=3C(C)=NC(C)=NC3)C2)C4=CC(F)=CC=C4
Tpsa: 77
Logp: 3.74204
H Acceptors: 5
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:
C₂₂H₂₀F₂N₄O₂
Molecular Weight:
410.42
Synonyms:
None
SMILES:
C(NC1=CC=C(F)C=N1)(=O)[C@@]2([C@H](COC=3C(C)=NC(C)=NC3)C2)C4=CC(F)=CC=C4
Tpsa:
77
Logp:
3.74204
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
6