CS-0943907
(3aR,4R,7S,7aS)-2-(((1S,2S)-2-((4-(benzo[d]isothiazol-3-yl)piperazin-1-yl)methyl)cyclohexyl)methyl)hexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Manufacturer: ChemScene
CAS Number: 1318074-27-9
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Purity
97%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₂₈H₃₆N₄O₂S
Molecular Weight
492.68
Synonyms
None
SMILES
O=C1[C@]2([C@]([C@@]3(C[C@]2(CC3)[H])[H])(C(=O)N1C[C@@H]4[C@@H](CN5CCN(CC5)C=6C=7C(SN6)=CC=CC7)CCCC4)[H])[H]
Tpsa
56.75
Logp
4.2558
H Acceptors
6
H Donors
0
Rotatable Bonds
5
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 1318074-27-9 | (3AR,4R,7S,7aS)-2-(((1S,2S)-2-((4-(benzo[d]isothiazol-3-yl)piperazin-1-yl)methyl)cyclohexyl)methyl)hexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione | A2B Chem | -- |
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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: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₈H₃₆N₄O₂S
Molecular Weight: 492.68
Synonyms: None
SMILES: O=C1[C@]2([C@]([C@@]3(C[C@]2(CC3)[H])[H])(C(=O)N1C[C@@H]4[C@@H](CN5CCN(CC5)C=6C=7C(SN6)=CC=CC7)CCCC4)[H])[H]
Tpsa: 56.75
Logp: 4.2558
H Acceptors: 6
H Donors: 0
Rotatable Bonds: 5
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₈H₃₆N₄O₂S
Molecular Weight:
492.68
Synonyms:
None
SMILES:
O=C1[C@]2([C@]([C@@]3(C[C@]2(CC3)[H])[H])(C(=O)N1C[C@@H]4[C@@H](CN5CCN(CC5)C=6C=7C(SN6)=CC=CC7)CCCC4)[H])[H]
Tpsa:
56.75
Logp:
4.2558
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
5
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₀INO
Molecular Weight: 287.10
Synonyms: None
SMILES: IC=1C=CC2=C(OC=C2CCN)C1
Tpsa: 39.16
Logp: 2.5386
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 2
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₀INO
Molecular Weight:
287.10
Synonyms:
None
SMILES:
IC=1C=CC2=C(OC=C2CCN)C1
Tpsa:
39.16
Logp:
2.5386
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
2
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₇NO
Molecular Weight: 155.24
Synonyms: None
SMILES: O=C(C1CNCC1)C(C)(C)C
Tpsa: 29.1
Logp: 1.2111
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 1
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₇NO
Molecular Weight:
155.24
Synonyms:
None
SMILES:
O=C(C1CNCC1)C(C)(C)C
Tpsa:
29.1
Logp:
1.2111
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
1
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₁₇Br
Molecular Weight: 193.12
Synonyms: None
SMILES: BrCCC(C)C(C)CC
Tpsa: 0
Logp: 3.4536
H Acceptors: 0
H Donors: 0
Rotatable Bonds: 4
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₁₇Br
Molecular Weight:
193.12
Synonyms:
None
SMILES:
BrCCC(C)C(C)CC
Tpsa:
0
Logp:
3.4536
H Acceptors:
0
H Donors:
0
Rotatable Bonds:
4