CS-0379695
1-Cyclopropyl-8-ethoxy-6-fluoro-7-((4aS,7aS)-hexahydro-1H-pyrrolo[3,4-b]pyridin-6(2H)-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid hydrochloride Moxifloxacin Impurity
Manufacturer: ChemScene
CAS Number: 2252446-70-9
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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
C₂₂H₂₇ClFN₃O₄
Molecular Weight
451.92
Synonyms
None
SMILES
CCOC1=C2N(C3CC3)C=C(C(C2=CC(F)=C1N4C[C@@]5([H])[C@@](NCCC5)([H])C4)=O)C(O)=O.Cl
Tpsa
83.8
Logp
3.1824
H Acceptors
6
H Donors
2
Rotatable Bonds
5
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: C₂₂H₂₇ClFN₃O₄
Molecular Weight: 451.92
Synonyms: None
SMILES: CCOC1=C2N(C3CC3)C=C(C(C2=CC(F)=C1N4C[C@@]5([H])[C@@](NCCC5)([H])C4)=O)C(O)=O.Cl
Tpsa: 83.8
Logp: 3.1824
H Acceptors: 6
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:
C₂₂H₂₇ClFN₃O₄
Molecular Weight:
451.92
Synonyms:
None
SMILES:
CCOC1=C2N(C3CC3)C=C(C(C2=CC(F)=C1N4C[C@@]5([H])[C@@](NCCC5)([H])C4)=O)C(O)=O.Cl
Tpsa:
83.8
Logp:
3.1824
H Acceptors:
6
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: C₂₃H₂₇Cl₂N₃O₂
Molecular Weight: 448.39
Synonyms: Aripiprazole Impurity 19
SMILES: O=C1NC2=C(CC1)C(OCCCCN3CCN(CC3)C4=C(Cl)C(Cl)=CC=C4)=CC=C2
Tpsa: 44.81
Logp: 4.8593
H Acceptors: 4
H Donors: 1
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:
C₂₃H₂₇Cl₂N₃O₂
Molecular Weight:
448.39
Synonyms:
Aripiprazole Impurity 19
SMILES:
O=C1NC2=C(CC1)C(OCCCCN3CCN(CC3)C4=C(Cl)C(Cl)=CC=C4)=CC=C2
Tpsa:
44.81
Logp:
4.8593
H Acceptors:
4
H Donors:
1
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: C₁₇H₁₆BrClO₂
Molecular Weight: 367.66
Synonyms: None
SMILES: ClC(C=CC(Br)=C1)=C1CC2=C(C=CC=C2)O[C@H]3CCOC3
Tpsa: 18.46
Logp: 4.861
H Acceptors: 2
H Donors: 0
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:
C₁₇H₁₆BrClO₂
Molecular Weight:
367.66
Synonyms:
None
SMILES:
ClC(C=CC(Br)=C1)=C1CC2=C(C=CC=C2)O[C@H]3CCOC3
Tpsa:
18.46
Logp:
4.861
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
4
Purity: 98%
MDL No: MFCD13194822
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₉H₂₃ClN₂O₅
Molecular Weight: 394.85
Synonyms: Desmethyl amolodipine
SMILES: O=C(C1=C(C)NC(COCCN)=C(C1C2=C(Cl)C=CC=C2)C(OCC)=O)O
Tpsa: 110.88
Logp: 2.1779
H Acceptors: 6
H Donors: 3
Rotatable Bonds: 8
Purity:
98%
MDL No:
MFCD13194822
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₉H₂₃ClN₂O₅
Molecular Weight:
394.85
Synonyms:
Desmethyl amolodipine
SMILES:
O=C(C1=C(C)NC(COCCN)=C(C1C2=C(Cl)C=CC=C2)C(OCC)=O)O
Tpsa:
110.88
Logp:
2.1779
H Acceptors:
6
H Donors:
3
Rotatable Bonds:
8