CS-1001109
Crizotinib Impurity 17
Manufacturer: ChemScene
CAS Number: 1346818-25-4
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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
C₁₅H₁₃BrFN₅O
Molecular Weight
378.20
Synonyms
None
SMILES
[C@@H](OC1=C(N)N=CC(Br)=C1)(C)C2=C(C=CC(F)=C2)N3N=CC=N3
Tpsa
78.85
Logp
3.2861
H Acceptors
6
H Donors
1
Rotatable Bonds
4
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: C₁₅H₁₃BrFN₅O
Molecular Weight: 378.20
Synonyms: None
SMILES: [C@@H](OC1=C(N)N=CC(Br)=C1)(C)C2=C(C=CC(F)=C2)N3N=CC=N3
Tpsa: 78.85
Logp: 3.2861
H Acceptors: 6
H Donors: 1
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₁₃BrFN₅O
Molecular Weight:
378.20
Synonyms:
None
SMILES:
[C@@H](OC1=C(N)N=CC(Br)=C1)(C)C2=C(C=CC(F)=C2)N3N=CC=N3
Tpsa:
78.85
Logp:
3.2861
H Acceptors:
6
H Donors:
1
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₂H₃₉NO₃
Molecular Weight: 485.66
Synonyms: None
SMILES: O=C(O)C(C1=CC=C(C=C1)C(O)CCCN2CCC(CC2)C(C=3C=CC=CC3)C=4C=CC=CC4)(C)C
Tpsa: 60.77
Logp: 6.4065
H Acceptors: 3
H Donors: 2
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:
C₃₂H₃₉NO₃
Molecular Weight:
485.66
Synonyms:
None
SMILES:
O=C(O)C(C1=CC=C(C=C1)C(O)CCCN2CCC(CC2)C(C=3C=CC=CC3)C=4C=CC=CC4)(C)C
Tpsa:
60.77
Logp:
6.4065
H Acceptors:
3
H Donors:
2
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: C₂₂H₃₀FN₃NaO₆S
Molecular Weight: 506.54
Synonyms: None
SMILES: C(C[C@H](C[C@H](CC(O)=O)O)O)C=1C(=NC(N(S(C)(=O)=O)C)=NC1C(C)C)C2=CC=C(F)C=C2.[Na]
Tpsa: 140.92
Logp: 1.9403
H Acceptors: 7
H Donors: 3
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:
C₂₂H₃₀FN₃NaO₆S
Molecular Weight:
506.54
Synonyms:
None
SMILES:
C(C[C@H](C[C@H](CC(O)=O)O)O)C=1C(=NC(N(S(C)(=O)=O)C)=NC1C(C)C)C2=CC=C(F)C=C2.[Na]
Tpsa:
140.92
Logp:
1.9403
H Acceptors:
7
H Donors:
3
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: C₁₃H₁₄I₃N₃O₆
Molecular Weight: 688.98
Synonyms: None
SMILES: O=C(N)C1=C(I)C(NC(=O)CO)=C(I)C(C(=O)NCC(O)CO)=C1I
Tpsa: 161.98
Logp: -0.3869
H Acceptors: 6
H Donors: 6
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:
C₁₃H₁₄I₃N₃O₆
Molecular Weight:
688.98
Synonyms:
None
SMILES:
O=C(N)C1=C(I)C(NC(=O)CO)=C(I)C(C(=O)NCC(O)CO)=C1I
Tpsa:
161.98
Logp:
-0.3869
H Acceptors:
6
H Donors:
6
Rotatable Bonds:
7