CS-1002656
Regorafenib Impurity 14
Manufacturer: ChemScene
CAS Number: 2161381-19-5
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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
C₁₄H₁₂FN₃O₃
Molecular Weight
289.26
Synonyms
None
SMILES
O=CNC1=CC=C(OC=2C=CN=C(C2)C(=O)NC)C=C1F
Tpsa
80.32
Logp
1.9409
H Acceptors
4
H Donors
2
Rotatable Bonds
5
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: C₁₄H₁₂FN₃O₃
Molecular Weight: 289.26
Synonyms: None
SMILES: O=CNC1=CC=C(OC=2C=CN=C(C2)C(=O)NC)C=C1F
Tpsa: 80.32
Logp: 1.9409
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₂FN₃O₃
Molecular Weight:
289.26
Synonyms:
None
SMILES:
O=CNC1=CC=C(OC=2C=CN=C(C2)C(=O)NC)C=C1F
Tpsa:
80.32
Logp:
1.9409
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
5
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₁₄N₂O₃
Molecular Weight: 282.29
Synonyms: None
SMILES: O=C1NC(C=2C=CC=CC2)(C=3C=CC=CC3)C(=O)N1CO
Tpsa: 69.64
Logp: 1.4318
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 3
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₁₄N₂O₃
Molecular Weight:
282.29
Synonyms:
None
SMILES:
O=C1NC(C=2C=CC=CC2)(C=3C=CC=CC3)C(=O)N1CO
Tpsa:
69.64
Logp:
1.4318
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
3
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₈H₄₄O₂
Molecular Weight: 412.65
Synonyms: None
SMILES: C[C@@]12[C@](\C(=C\C=C\3/C(=C)[C@@H](O)C[C@@H](O)C3)\CCC1)(CC[C@@]2([C@@H](/C=C/[C@@H](C(C)C)C)C)[H])[H]
Tpsa: 40.46
Logp: 6.6118
H Acceptors: 2
H Donors: 2
Rotatable Bonds: 5
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₈H₄₄O₂
Molecular Weight:
412.65
Synonyms:
None
SMILES:
C[C@@]12[C@](\C(=C\C=C\3/C(=C)[C@@H](O)C[C@@H](O)C3)\CCC1)(CC[C@@]2([C@@H](/C=C/[C@@H](C(C)C)C)C)[H])[H]
Tpsa:
40.46
Logp:
6.6118
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₈O₅
Molecular Weight: 230.26
Synonyms: None
SMILES: O=C(OCC)C(C(=O)OCC)C(=O)CCC
Tpsa: 69.67
Logp: 1.098
H Acceptors: 5
H Donors: 0
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:
C₁₁H₁₈O₅
Molecular Weight:
230.26
Synonyms:
None
SMILES:
O=C(OCC)C(C(=O)OCC)C(=O)CCC
Tpsa:
69.67
Logp:
1.098
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
7