CS-1005362
Quetiapine Impurity 51
Manufacturer: ChemScene
CAS Number: 936094-62-1
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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
C₁₀H₂₀N₂O₃
Molecular Weight
216.28
Synonyms
None
SMILES
O=C(OCCOCCN1CCNCC1)C
Tpsa
50.8
Logp
-0.5287
H Acceptors
5
H Donors
1
Rotatable Bonds
6
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: C₁₀H₂₀N₂O₃
Molecular Weight: 216.28
Synonyms: None
SMILES: O=C(OCCOCCN1CCNCC1)C
Tpsa: 50.8
Logp: -0.5287
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:
C₁₀H₂₀N₂O₃
Molecular Weight:
216.28
Synonyms:
None
SMILES:
O=C(OCCOCCN1CCNCC1)C
Tpsa:
50.8
Logp:
-0.5287
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: C₃₀H₃₆N₆O₁₀S₂
Molecular Weight: 704.77
Synonyms: None
SMILES: C(N(C)C)(=O)[C@H]1N(C(OCC2=CC=C(N(=O)=O)C=C2)=O)C[C@@H](SS[C@@H]3CN(C(OCC4=CC=C(N(=O)=O)C=C4)=O)[C@H](C(N(C)C)=O)C3)C1
Tpsa: 185.98
Logp: 3.92
H Acceptors: 12
H Donors: 0
Rotatable Bonds: 11
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₀H₃₆N₆O₁₀S₂
Molecular Weight:
704.77
Synonyms:
None
SMILES:
C(N(C)C)(=O)[C@H]1N(C(OCC2=CC=C(N(=O)=O)C=C2)=O)C[C@@H](SS[C@@H]3CN(C(OCC4=CC=C(N(=O)=O)C=C4)=O)[C@H](C(N(C)C)=O)C3)C1
Tpsa:
185.98
Logp:
3.92
H Acceptors:
12
H Donors:
0
Rotatable Bonds:
11
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₇H₁₈ClN₃O₄S
Molecular Weight: 395.86
Synonyms: None
SMILES: O=C1N(C[C@H](CNC(=O)C=2SC(Cl)=CC2)O1)C3=CC=C(NCCO)C=C3
Tpsa: 90.9
Logp: 2.5609
H Acceptors: 6
H Donors: 3
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₇H₁₈ClN₃O₄S
Molecular Weight:
395.86
Synonyms:
None
SMILES:
O=C1N(C[C@H](CNC(=O)C=2SC(Cl)=CC2)O1)C3=CC=C(NCCO)C=C3
Tpsa:
90.9
Logp:
2.5609
H Acceptors:
6
H Donors:
3
Rotatable Bonds:
7
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₇H₁₄F₂O₂
Molecular Weight: 288.29
Synonyms: None
SMILES: O=C(C1=CC=C(F)C=C1)CCCC(=O)C2=CC=C(F)C=C2
Tpsa: 34.14
Logp: 4.2007
H Acceptors: 2
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:
C₁₇H₁₄F₂O₂
Molecular Weight:
288.29
Synonyms:
None
SMILES:
O=C(C1=CC=C(F)C=C1)CCCC(=O)C2=CC=C(F)C=C2
Tpsa:
34.14
Logp:
4.2007
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
6