CS-1062490
(3R)-11,11-Difluoro-3-methyl-1,3,4,7,8,9,10,11-octahydro-2H-pyrido[4',3':3,4]pyrazolo[1,5-a]azepin-10-ol
Manufacturer: ChemScene
CAS Number: 2561474-18-6
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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
C₁₂H₁₇F₂N₃O
Molecular Weight
257.28
Synonyms
None
SMILES
FC1(F)C2=C3C(=NN2CCCC1O)C[C@@H](C)NC3
Tpsa
50.08
Logp
1.1638
H Acceptors
4
H Donors
2
Rotatable Bonds
0
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: C₁₂H₁₇F₂N₃O
Molecular Weight: 257.28
Synonyms: None
SMILES: FC1(F)C2=C3C(=NN2CCCC1O)C[C@@H](C)NC3
Tpsa: 50.08
Logp: 1.1638
H Acceptors: 4
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:
C₁₂H₁₇F₂N₃O
Molecular Weight:
257.28
Synonyms:
None
SMILES:
FC1(F)C2=C3C(=NN2CCCC1O)C[C@@H](C)NC3
Tpsa:
50.08
Logp:
1.1638
H Acceptors:
4
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: C₁₀H₁₆N₃O+
Molecular Weight: 194.25
Synonyms: None
SMILES: C[N+]1=NN2[C@@]3([C@@](OCC2=C1)(CCCC3)[H])[H]
Tpsa: 30.93
Logp: 0.7215
H Acceptors: 3
H Donors: 0
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:
C₁₀H₁₆N₃O+
Molecular Weight:
194.25
Synonyms:
None
SMILES:
C[N+]1=NN2[C@@]3([C@@](OCC2=C1)(CCCC3)[H])[H]
Tpsa:
30.93
Logp:
0.7215
H Acceptors:
3
H Donors:
0
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: C₁₃H₁₃NO₃
Molecular Weight: 231.25
Synonyms: None
SMILES: O=C(OC)C=1C=CC=2N=C(C=C(C2C1)C)CO
Tpsa: 59.42
Logp: 1.82212
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₃NO₃
Molecular Weight:
231.25
Synonyms:
None
SMILES:
O=C(OC)C=1C=CC=2N=C(C=C(C2C1)C)CO
Tpsa:
59.42
Logp:
1.82212
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₄N₂O₃
Molecular Weight: 198.22
Synonyms: None
SMILES: O=C(N1N=C(C=C1OC)COC)CC
Tpsa: 53.35
Logp: 1.0883
H Acceptors: 5
H Donors: 0
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:
C₉H₁₄N₂O₃
Molecular Weight:
198.22
Synonyms:
None
SMILES:
O=C(N1N=C(C=C1OC)COC)CC
Tpsa:
53.35
Logp:
1.0883
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
4