CS-0548094
4-(4-Benzylpiperazin-1-yl)-1H-indole dihydrochloride hydrate
Manufacturer: ChemScene
CAS Number: 690632-86-1
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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
C₁₉H₂₅Cl₂N₃O
Molecular Weight
382.33
Synonyms
4-(4-Benzylpiperazino)-1H-indole2HClmonohydrate
SMILES
C1CN(CCN1CC2=CC=CC=C2)C3=CC=CC4=C3C=CN4.O.Cl.Cl
Tpsa
53.77
Logp
3.509
H Acceptors
2
H Donors
1
Rotatable Bonds
3
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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: C₁₉H₂₅Cl₂N₃O
Molecular Weight: 382.33
Synonyms: 4-(4-Benzylpiperazino)-1H-indole2HClmonohydrate
SMILES: C1CN(CCN1CC2=CC=CC=C2)C3=CC=CC4=C3C=CN4.O.Cl.Cl
Tpsa: 53.77
Logp: 3.509
H Acceptors: 2
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:
C₁₉H₂₅Cl₂N₃O
Molecular Weight:
382.33
Synonyms:
4-(4-Benzylpiperazino)-1H-indole2HClmonohydrate
SMILES:
C1CN(CCN1CC2=CC=CC=C2)C3=CC=CC4=C3C=CN4.O.Cl.Cl
Tpsa:
53.77
Logp:
3.509
H Acceptors:
2
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: C₇H₁₂N₂O
Molecular Weight: 140.18
Synonyms: 3-tert-butyl-1H-pyrazol-5-ol
SMILES: CC(C)(C)C1=CC(=O)NN1
Tpsa: 48.65
Logp: 1.0005
H Acceptors: 1
H Donors: 2
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:
C₇H₁₂N₂O
Molecular Weight:
140.18
Synonyms:
3-tert-butyl-1H-pyrazol-5-ol
SMILES:
CC(C)(C)C1=CC(=O)NN1
Tpsa:
48.65
Logp:
1.0005
H Acceptors:
1
H Donors:
2
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: C₁₅H₂₀ClN₃O
Molecular Weight: 293.79
Synonyms: None
SMILES: CC(C)(C)C(C(CC1=CC=CC=C1Cl)N2C=NC=N2)O
Tpsa: 50.94
Logp: 3.1223
H Acceptors: 4
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:
C₁₅H₂₀ClN₃O
Molecular Weight:
293.79
Synonyms:
None
SMILES:
CC(C)(C)C(C(CC1=CC=CC=C1Cl)N2C=NC=N2)O
Tpsa:
50.94
Logp:
3.1223
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Store at room temperature
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₁H₁₄O₇
Molecular Weight: 378.33
Synonyms: 3,3'-carbonyl bis(7-methoxycoumarin)
SMILES: COC1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)C3=CC4=C(C=C(C=C4)OC)OC3=O
Tpsa: 95.95
Logp: 3.1476
H Acceptors: 7
H Donors: 0
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Store at room temperature
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₁H₁₄O₇
Molecular Weight:
378.33
Synonyms:
3,3'-carbonyl bis(7-methoxycoumarin)
SMILES:
COC1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)C3=CC4=C(C=C(C=C4)OC)OC3=O
Tpsa:
95.95
Logp:
3.1476
H Acceptors:
7
H Donors:
0
Rotatable Bonds:
4