CS-0571201
(E)-4-((4-((3-chloro-4-(pyridin-2-ylmethoxy)phenyl)amino)-3-cyano-7-ethoxyquinolin-6-yl)amino)-N,N-dimethyl-4-oxobut-2-en-1-amine oxide
Manufacturer: ChemScene
CAS Number: 1376615-55-2
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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
C₃₀H₂₉ClN₆O₄
Molecular Weight
573.04
Synonyms
Neratinib dimethylamine N-oxide
SMILES
CCOC1=C(C=C2C(=C1)N=CC(=C2NC3=CC(=C(C=C3)OCC4=CC=CC=N4)Cl)C#N)NC(=O)/C=C/C[N+](C)(C)[O-]
Tpsa
132.22
Logp
5.94508
H Acceptors
8
H Donors
2
Rotatable Bonds
11
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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: C₃₀H₂₉ClN₆O₄
Molecular Weight: 573.04
Synonyms: Neratinib dimethylamine N-oxide
SMILES: CCOC1=C(C=C2C(=C1)N=CC(=C2NC3=CC(=C(C=C3)OCC4=CC=CC=N4)Cl)C#N)NC(=O)/C=C/C[N+](C)(C)[O-]
Tpsa: 132.22
Logp: 5.94508
H Acceptors: 8
H Donors: 2
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:
C₃₀H₂₉ClN₆O₄
Molecular Weight:
573.04
Synonyms:
Neratinib dimethylamine N-oxide
SMILES:
CCOC1=C(C=C2C(=C1)N=CC(=C2NC3=CC(=C(C=C3)OCC4=CC=CC=N4)Cl)C#N)NC(=O)/C=C/C[N+](C)(C)[O-]
Tpsa:
132.22
Logp:
5.94508
H Acceptors:
8
H Donors:
2
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: C₆H₁₄N₂O₂
Molecular Weight: 146.19
Synonyms: mildronate-010
SMILES: O=C(O)CCN(N(C)C)C
Tpsa: 43.78
Logp: -0.1305
H Acceptors: 3
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:
C₆H₁₄N₂O₂
Molecular Weight:
146.19
Synonyms:
mildronate-010
SMILES:
O=C(O)CCN(N(C)C)C
Tpsa:
43.78
Logp:
-0.1305
H Acceptors:
3
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: C₉H₁₂N₄O₂
Molecular Weight: 208.22
Synonyms: Palbociclib-029
SMILES: O=N(=O)C1=NC=CC=C1N2CCNCC2
Tpsa: 71.3
Logp: 0.3994
H Acceptors: 5
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:
C₉H₁₂N₄O₂
Molecular Weight:
208.22
Synonyms:
Palbociclib-029
SMILES:
O=N(=O)C1=NC=CC=C1N2CCNCC2
Tpsa:
71.3
Logp:
0.3994
H Acceptors:
5
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: C₁₈H₂₄N₄O₂
Molecular Weight: 328.41
Synonyms: Granisetron-001
SMILES: CN1C2=CC=CC=C2C(=N1)C(=O)NC3C[C@H]4CCC[C@@H](C3)[N+]4(C)[O-]
Tpsa: 69.98
Logp: 2.331
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:
C₁₈H₂₄N₄O₂
Molecular Weight:
328.41
Synonyms:
Granisetron-001
SMILES:
CN1C2=CC=CC=C2C(=N1)C(=O)NC3C[C@H]4CCC[C@@H](C3)[N+]4(C)[O-]
Tpsa:
69.98
Logp:
2.331
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
2