CS-0010320
Methanone, [(2S,4R)-4-[4-(3-methyl-1-phenyl-1H-pyrazol-5-yl)-1-piperazinyl]-2-pyrrolidinyl]-3-thiazolidinyl- hydrochloride
Manufacturer: ChemScene
CAS Number: None
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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
C₂₂H₃₁ClN₆OS
Molecular Weight
463.04
Synonyms
None
SMILES
CC1=NN(C2=CC=CC=C2)C(N3CCN([C@]4([H])C[C@](C(N5CSCC5)=O)([H])NC4)CC3)=C1.Cl
Tpsa
56.64
Logp
1.98792
H Acceptors
7
H Donors
1
Rotatable Bonds
4
Other Options
...
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SAFETY INFORMATION
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: C₂₂H₃₁ClN₆OS
Molecular Weight: 463.04
Synonyms: None
SMILES: CC1=NN(C2=CC=CC=C2)C(N3CCN([C@]4([H])C[C@](C(N5CSCC5)=O)([H])NC4)CC3)=C1.Cl
Tpsa: 56.64
Logp: 1.98792
H Acceptors: 7
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:
C₂₂H₃₁ClN₆OS
Molecular Weight:
463.04
Synonyms:
None
SMILES:
CC1=NN(C2=CC=CC=C2)C(N3CCN([C@]4([H])C[C@](C(N5CSCC5)=O)([H])NC4)CC3)=C1.Cl
Tpsa:
56.64
Logp:
1.98792
H Acceptors:
7
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: C₁₉H₂₆ClN₅O₂
Molecular Weight: 391.90
Synonyms: None
SMILES: CC1=NN(C2=CC=CC=C2)C(N3CCN([C@@]4([H])C[C@](C(O)=O)([H])NC4)CC3)=C1.Cl
Tpsa: 73.63
Logp: 1.53962
H Acceptors: 6
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:
C₁₉H₂₆ClN₅O₂
Molecular Weight:
391.90
Synonyms:
None
SMILES:
CC1=NN(C2=CC=CC=C2)C(N3CCN([C@@]4([H])C[C@](C(O)=O)([H])NC4)CC3)=C1.Cl
Tpsa:
73.63
Logp:
1.53962
H Acceptors:
6
H Donors:
2
Rotatable Bonds:
4
Purity: 98%
MDL No: MFCD18255264
Storage: Store at room temperature
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₅ClN₂O₂
Molecular Weight: 172.57
Synonyms: None
SMILES: CC1=NC=C(Cl)C=C1[N+]([O-])=O
Tpsa: 56.03
Logp: 1.95162
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 1
Purity:
98%
MDL No:
MFCD18255264
Storage:
Store at room temperature
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₅ClN₂O₂
Molecular Weight:
172.57
Synonyms:
None
SMILES:
CC1=NC=C(Cl)C=C1[N+]([O-])=O
Tpsa:
56.03
Logp:
1.95162
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
1
Purity: 97%
MDL No: MFCD17000078
Storage: RT, stored under nitrogen
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₆O₅
Molecular Weight: 182.13
Synonyms: 3-Hydroxyphthalicaci
SMILES: OC(C1=C(C(O)=O)C=CC=C1O)=O
Tpsa: 94.83
Logp: 0.7886
H Acceptors: 3
H Donors: 3
Rotatable Bonds: 2
Purity:
97%
MDL No:
MFCD17000078
Storage:
RT, stored under nitrogen
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₆O₅
Molecular Weight:
182.13
Synonyms:
3-Hydroxyphthalicaci
SMILES:
OC(C1=C(C(O)=O)C=CC=C1O)=O
Tpsa:
94.83
Logp:
0.7886
H Acceptors:
3
H Donors:
3
Rotatable Bonds:
2