CS-1001460
Afatinib Impurity S
Manufacturer: ChemScene
CAS Number: 1449430-53-8
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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
C₁₄H₁₀ClFN₄O
Molecular Weight
304.71
Synonyms
None
SMILES
FC1=CC=C(C=C1Cl)NC=2N=CN=C3C=C(O)C(N)=CC32
Tpsa
84.06
Logp
3.4537
H Acceptors
5
H Donors
3
Rotatable Bonds
2
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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: C₁₄H₁₀ClFN₄O
Molecular Weight: 304.71
Synonyms: None
SMILES: FC1=CC=C(C=C1Cl)NC=2N=CN=C3C=C(O)C(N)=CC32
Tpsa: 84.06
Logp: 3.4537
H Acceptors: 5
H Donors: 3
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:
C₁₄H₁₀ClFN₄O
Molecular Weight:
304.71
Synonyms:
None
SMILES:
FC1=CC=C(C=C1Cl)NC=2N=CN=C3C=C(O)C(N)=CC32
Tpsa:
84.06
Logp:
3.4537
H Acceptors:
5
H Donors:
3
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: C₁₆H₁₄O₄
Molecular Weight: 270.28
Synonyms: None
SMILES: O=C(O)C(C=1C=CC=C(C1)C(=O)C2=CC=C(O)C=C2)C
Tpsa: 74.6
Logp: 2.8113
H Acceptors: 3
H Donors: 2
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:
C₁₆H₁₄O₄
Molecular Weight:
270.28
Synonyms:
None
SMILES:
O=C(O)C(C=1C=CC=C(C1)C(=O)C2=CC=C(O)C=C2)C
Tpsa:
74.6
Logp:
2.8113
H Acceptors:
3
H Donors:
2
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: C₂₃H₂₉N₅O₈S
Molecular Weight: 535.57
Synonyms: None
SMILES: [C@@H](NC([C@H](NC(=O)N1C(=O)C(=O)N(CC)CC1)C2=CC=CC=C2)=O)(C(O)=O)[C@]3(N[C@@H](C(O)=O)C(C)(C)S3)[H]
Tpsa: 185.45
Logp: -0.4083
H Acceptors: 8
H Donors: 5
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:
C₂₃H₂₉N₅O₈S
Molecular Weight:
535.57
Synonyms:
None
SMILES:
[C@@H](NC([C@H](NC(=O)N1C(=O)C(=O)N(CC)CC1)C2=CC=CC=C2)=O)(C(O)=O)[C@]3(N[C@@H](C(O)=O)C(C)(C)S3)[H]
Tpsa:
185.45
Logp:
-0.4083
H Acceptors:
8
H Donors:
5
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: C₁₀H₇F₂N₃O
Molecular Weight: 223.18
Synonyms: None
SMILES: FC1=CC=C(C(F)=C1)C(O)=CN2N=CN=C2
Tpsa: 50.94
Logp: 2.0699
H Acceptors: 4
H Donors: 1
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:
C₁₀H₇F₂N₃O
Molecular Weight:
223.18
Synonyms:
None
SMILES:
FC1=CC=C(C(F)=C1)C(O)=CN2N=CN=C2
Tpsa:
50.94
Logp:
2.0699
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
2