CS-0532847
Bis(2-(benzyl(methyl)amino)ethyl) 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate dihydrochloride Nicardipine Impurity
Manufacturer: ChemScene
CAS Number: 71784-27-5
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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
C₃₅H₄₂Cl₂N₄O₆
Molecular Weight
685.64
Synonyms
None
SMILES
O=C(C1=C(C)NC(C)=C(C1C2=CC([N+]([O-])=O)=CC=C2)C(OCCN(CC3=CC=CC=C3)C)=O)OCCN(CC4=CC=CC=C4)C.Cl.Cl
Tpsa
114.25
Logp
6.0236
H Acceptors
9
H Donors
1
Rotatable Bonds
14
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 71784-27-5 | Nicardipine Related Compound D (Bis{2-[benzyl(methyl)amino]ethyl} 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate dihydrochloride) | A2B Chem | ₹ 83,249.88 |
SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/toxic.svg
Pictograms
Signal Word
Danger
UN Number
2811
Class
6.1
Packing Group
Ⅲ
Hazard Statements
Precautionary Statements
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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: C₃₅H₄₂Cl₂N₄O₆
Molecular Weight: 685.64
Synonyms: None
SMILES: O=C(C1=C(C)NC(C)=C(C1C2=CC([N+]([O-])=O)=CC=C2)C(OCCN(CC3=CC=CC=C3)C)=O)OCCN(CC4=CC=CC=C4)C.Cl.Cl
Tpsa: 114.25
Logp: 6.0236
H Acceptors: 9
H Donors: 1
Rotatable Bonds: 14
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₅H₄₂Cl₂N₄O₆
Molecular Weight:
685.64
Synonyms:
None
SMILES:
O=C(C1=C(C)NC(C)=C(C1C2=CC([N+]([O-])=O)=CC=C2)C(OCCN(CC3=CC=CC=C3)C)=O)OCCN(CC4=CC=CC=C4)C.Cl.Cl
Tpsa:
114.25
Logp:
6.0236
H Acceptors:
9
H Donors:
1
Rotatable Bonds:
14
Purity: 98%
MDL No: MFCD16293844
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₀H₂₅NO₃
Molecular Weight: 327.42
Synonyms: Ethyl 3-(4-(2-(5-ethylpyridin-2-yl)ethoxy)phenyl)propanoate
SMILES: O=C(CCC1=CC=C(C=C1)OCCC2=NC=C(CC)C=C2)OCC
Tpsa: 48.42
Logp: 3.7612
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 9
Purity:
98%
MDL No:
MFCD16293844
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₂₅NO₃
Molecular Weight:
327.42
Synonyms:
Ethyl 3-(4-(2-(5-ethylpyridin-2-yl)ethoxy)phenyl)propanoate
SMILES:
O=C(CCC1=CC=C(C=C1)OCCC2=NC=C(CC)C=C2)OCC
Tpsa:
48.42
Logp:
3.7612
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
9
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₉H₂₄F₃N₇O
Molecular Weight: 543.54
Synonyms: NILOTINIB IMPURITY 11
SMILES: O=C(C1=CC=C(C)C(NC2=NC(C3=CN=CC=C3)=CC=N2)=C1)NC4=CC(C(F)(F)F)=CC(N5C=NC(CC)=C5)=C4
Tpsa: 97.62
Logp: 6.60982
H Acceptors: 7
H Donors: 2
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:
C₂₉H₂₄F₃N₇O
Molecular Weight:
543.54
Synonyms:
NILOTINIB IMPURITY 11
SMILES:
O=C(C1=CC=C(C)C(NC2=NC(C3=CN=CC=C3)=CC=N2)=C1)NC4=CC(C(F)(F)F)=CC(N5C=NC(CC)=C5)=C4
Tpsa:
97.62
Logp:
6.60982
H Acceptors:
7
H Donors:
2
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: C₁₄H₂₂N₂O₅S
Molecular Weight: 330.40
Synonyms: (pivaloyloxy)methyl 6β-aminopenicillate
SMILES: CC(C)(C)C(OCOC([C@@H]1N2[C@@](SC1(C)C)([H])[C@@H](C2=O)N)=O)=O
Tpsa: 98.93
Logp: 0.466
H Acceptors: 7
H Donors: 1
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₂₂N₂O₅S
Molecular Weight:
330.40
Synonyms:
(pivaloyloxy)methyl 6β-aminopenicillate
SMILES:
CC(C)(C)C(OCOC([C@@H]1N2[C@@](SC1(C)C)([H])[C@@H](C2=O)N)=O)=O
Tpsa:
98.93
Logp:
0.466
H Acceptors:
7
H Donors:
1
Rotatable Bonds:
3