CS-0533439
(2S,3S,5S,8R,9S,10S,13S,14S)-10,13-Dimethyl-17-oxo-2-(piperidin-1-yl)hexadecahydro-1H-cyclopenta[a]phenanthren-3-yl acetate Vecuronium Bromide Impurity
Manufacturer: ChemScene
CAS Number: 18668-29-6
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Purity
98%
MDL No
MFCD29079087
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₂₆H₄₁NO₃
Molecular Weight
415.61
Synonyms
DES(1-methylpiperidinium)-17-oxo vecuronium
SMILES
C[C@@]12[C@]3([H])[C@](CC[C@@]1([H])C[C@@H]([C@](N4CCCCC4)([H])C2)OC(C)=O)([H])[C@@]5([H])[C@](CC3)(C(CC5)=O)C
Tpsa
46.61
Logp
4.9943
H Acceptors
4
H Donors
0
Rotatable Bonds
2
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 18668-29-6 | 2β-(Piperidin-1-yl)-17-oxo-5α-androstan-3α-yl Acetate | A2B Chem | -- |
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-P330-P362+P364-P501
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Purity: 98%
MDL No: MFCD29079087
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₆H₄₁NO₃
Molecular Weight: 415.61
Synonyms: DES(1-methylpiperidinium)-17-oxo vecuronium
SMILES: C[C@@]12[C@]3([H])[C@](CC[C@@]1([H])C[C@@H]([C@](N4CCCCC4)([H])C2)OC(C)=O)([H])[C@@]5([H])[C@](CC3)(C(CC5)=O)C
Tpsa: 46.61
Logp: 4.9943
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 2
Purity:
98%
MDL No:
MFCD29079087
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₆H₄₁NO₃
Molecular Weight:
415.61
Synonyms:
DES(1-methylpiperidinium)-17-oxo vecuronium
SMILES:
C[C@@]12[C@]3([H])[C@](CC[C@@]1([H])C[C@@H]([C@](N4CCCCC4)([H])C2)OC(C)=O)([H])[C@@]5([H])[C@](CC3)(C(CC5)=O)C
Tpsa:
46.61
Logp:
4.9943
H Acceptors:
4
H Donors:
0
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: C₂₃H₂₈O₅
Molecular Weight: 384.47
Synonyms: Eplerenone Impurity A
SMILES: C[C@@]12[C@]34[C@]([C@@H](CC1=CC(CC2)=O)C(O4)=O)([H])[C@@]5([H])[C@](CC3)([C@@]6(OC(CC6)=O)CC5)C
Tpsa: 69.67
Logp: 3.4996
H Acceptors: 5
H Donors: 0
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₃H₂₈O₅
Molecular Weight:
384.47
Synonyms:
Eplerenone Impurity A
SMILES:
C[C@@]12[C@]34[C@]([C@@H](CC1=CC(CC2)=O)C(O4)=O)([H])[C@@]5([H])[C@](CC3)([C@@]6(OC(CC6)=O)CC5)C
Tpsa:
69.67
Logp:
3.4996
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₇H₁₇N₃O₅
Molecular Weight: 343.33
Synonyms: Isradipine Impurity 3（Isradipine EP Impurity C）
SMILES: O=C(C1=C(C)NC(C)=C(C1C2=CC=CC3=NON=C32)C(OC)=O)OC
Tpsa: 103.55
Logp: 1.8036
H Acceptors: 8
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:
C₁₇H₁₇N₃O₅
Molecular Weight:
343.33
Synonyms:
Isradipine Impurity 3（Isradipine EP Impurity C）
SMILES:
O=C(C1=C(C)NC(C)=C(C1C2=CC=CC3=NON=C32)C(OC)=O)OC
Tpsa:
103.55
Logp:
1.8036
H Acceptors:
8
H Donors:
1
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: 4°C, protect from light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₂₁BrN₂
Molecular Weight: 297.23
Synonyms: 4-bromo-2-((cyclohexyl(methyl)amino)methyl)aniline
SMILES: BrC1=CC=C(C(CN(C2CCCCC2)C)=C1)N
Tpsa: 29.26
Logp: 3.7958
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
4°C, protect from light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₂₁BrN₂
Molecular Weight:
297.23
Synonyms:
4-bromo-2-((cyclohexyl(methyl)amino)methyl)aniline
SMILES:
BrC1=CC=C(C(CN(C2CCCCC2)C)=C1)N
Tpsa:
29.26
Logp:
3.7958
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
3