CS-0018564
6-Chloro-5-((2R,5S)-4-(4-fluorobenzyl)-2,5-dimethylpiperazine-1-carbonyl)-1-methyl-1H-indole-3-carbaldehyde
Manufacturer: ChemScene
CAS Number: None
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Purity
97%
MDL No
None
Storage
4°C, stored under nitrogen
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₂₄H₂₅ClFN₃O₂
Molecular Weight
441.93
Synonyms
None
SMILES
[H]C(C1=CN(C)C2=C1C=C(C(N3[C@H](C)CN(CC4=CC=C(F)C=C4)[C@@H](C)C3)=O)C(Cl)=C2)=O
Tpsa
45.55
Logp
4.5183
H Acceptors
4
H Donors
0
Rotatable Bonds
4
Other Options
...
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: 97%
MDL No: None
Storage: 4°C, stored under nitrogen
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₄H₂₅ClFN₃O₂
Molecular Weight: 441.93
Synonyms: None
SMILES: [H]C(C1=CN(C)C2=C1C=C(C(N3[C@H](C)CN(CC4=CC=C(F)C=C4)[C@@H](C)C3)=O)C(Cl)=C2)=O
Tpsa: 45.55
Logp: 4.5183
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 4
Purity:
97%
MDL No:
None
Storage:
4°C, stored under nitrogen
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₄H₂₅ClFN₃O₂
Molecular Weight:
441.93
Synonyms:
None
SMILES:
[H]C(C1=CN(C)C2=C1C=C(C(N3[C@H](C)CN(CC4=CC=C(F)C=C4)[C@@H](C)C3)=O)C(Cl)=C2)=O
Tpsa:
45.55
Logp:
4.5183
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
4
Purity: 98%
MDL No: MFCD00004659
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₁₀O₃
Molecular Weight: 154.16
Synonyms: p-(Hydroxymethyl)guaiacol
SMILES: OCC1=CC=C(O)C(OC)=C1
Tpsa: 49.69
Logp: 0.8931
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 2
Purity:
98%
MDL No:
MFCD00004659
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₁₀O₃
Molecular Weight:
154.16
Synonyms:
p-(Hydroxymethyl)guaiacol
SMILES:
OCC1=CC=C(O)C(OC)=C1
Tpsa:
49.69
Logp:
0.8931
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
2
Purity: 98%
MDL No: MFCD07371452
Storage: 4°C, stored under nitrogen
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₀H₃₄O₂
Molecular Weight: 306.48
Synonyms: None
SMILES: CC/C=C\C/C=C\C/C=C\CCCCCCCC(OCC)=O
Tpsa: 26.3
Logp: 6.139
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 14
Purity:
98%
MDL No:
MFCD07371452
Storage:
4°C, stored under nitrogen
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₃₄O₂
Molecular Weight:
306.48
Synonyms:
None
SMILES:
CC/C=C\C/C=C\C/C=C\CCCCCCCC(OCC)=O
Tpsa:
26.3
Logp:
6.139
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
14
Purity: 90%
MDL No: MFCD00001543
Storage: -20°C, stored under nitrogen
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₄O
Molecular Weight: 150.22
Synonyms: (S)-(-)-Perillaldehyde; (S)-Perillaldehyde
SMILES: O=CC1=CC[C@@H](C(C)=C)CC1
Tpsa: 17.07
Logp: 2.4879
H Acceptors: 1
H Donors: 0
Rotatable Bonds: 2
Purity:
90%
MDL No:
MFCD00001543
Storage:
-20°C, stored under nitrogen
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₄O
Molecular Weight:
150.22
Synonyms:
(S)-(-)-Perillaldehyde; (S)-Perillaldehyde
SMILES:
O=CC1=CC[C@@H](C(C)=C)CC1
Tpsa:
17.07
Logp:
2.4879
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
2