CS-1036173
(3aR,7aR)-4'-(benzo[d]isothiazol-3-yl)octahydrospiro[isoindole-2,1'-piperazin]-2-ium
Manufacturer: ChemScene
CAS Number: 186204-36-4
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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
C₁₉H₂₆N₃S+
Molecular Weight
328.49
Synonyms
None
SMILES
[N+]12(C[C@]3([C@](C1)(CCCC3)[H])[H])CCN(CC2)C=4C=5C(SN4)=CC=CC5
Tpsa
16.13
Logp
3.7531
H Acceptors
3
H Donors
0
Rotatable Bonds
1
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 186204-36-4 | Spiro[2H-isoindole-2,1′-piperazinium], 4′-(1,2-benzisothiazol-3-yl)octahydro-, (3aR,7aR)- | A2B Chem | -- |
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: C₁₉H₂₆N₃S+
Molecular Weight: 328.49
Synonyms: None
SMILES: [N+]12(C[C@]3([C@](C1)(CCCC3)[H])[H])CCN(CC2)C=4C=5C(SN4)=CC=CC5
Tpsa: 16.13
Logp: 3.7531
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₉H₂₆N₃S+
Molecular Weight:
328.49
Synonyms:
None
SMILES:
[N+]12(C[C@]3([C@](C1)(CCCC3)[H])[H])CCN(CC2)C=4C=5C(SN4)=CC=CC5
Tpsa:
16.13
Logp:
3.7531
H Acceptors:
3
H Donors:
0
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: C₉H₁₂N₂O₂
Molecular Weight: 180.20
Synonyms: None
SMILES: O=C(O)C1=CN=CC(=C1)N(C)CC
Tpsa: 53.43
Logp: 1.2359
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 3
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₂N₂O₂
Molecular Weight:
180.20
Synonyms:
None
SMILES:
O=C(O)C1=CN=CC(=C1)N(C)CC
Tpsa:
53.43
Logp:
1.2359
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
3
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅H₂₂N₂
Molecular Weight: 230.35
Synonyms: None
SMILES: NC1CCCC21CN(CC=3C=CC=CC3)CC2
Tpsa: 29.26
Logp: 2.3899
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:
C₁₅H₂₂N₂
Molecular Weight:
230.35
Synonyms:
None
SMILES:
NC1CCCC21CN(CC=3C=CC=CC3)CC2
Tpsa:
29.26
Logp:
2.3899
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: C₁₁H₂₀N₂O
Molecular Weight: 196.29
Synonyms: None
SMILES: O=C(NC)C1NCCC2CCCCC12
Tpsa: 41.13
Logp: 0.9007
H Acceptors: 2
H Donors: 2
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:
C₁₁H₂₀N₂O
Molecular Weight:
196.29
Synonyms:
None
SMILES:
O=C(NC)C1NCCC2CCCCC12
Tpsa:
41.13
Logp:
0.9007
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
1