CS-0792849
2,4-Dihydro-2-[(1S,2S)-1-ethyl-2-hydroxypropyl]-4[4-(1-piperazinyl)phenyl]-3H-1,2,4-triazol-3-one
Manufacturer: ChemScene
CAS Number: 2514953-93-4
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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
C₁₇H₂₅N₅O₂
Molecular Weight
331.41
Synonyms
None
SMILES
C[C@H](O)[C@H](CC)N1N=CN(C2=CC=C(N3CCNCC3)C=C2)C1=O
Tpsa
75.32
Logp
0.7755
H Acceptors
7
H Donors
2
Rotatable Bonds
5
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: C₁₇H₂₅N₅O₂
Molecular Weight: 331.41
Synonyms: None
SMILES: C[C@H](O)[C@H](CC)N1N=CN(C2=CC=C(N3CCNCC3)C=C2)C1=O
Tpsa: 75.32
Logp: 0.7755
H Acceptors: 7
H Donors: 2
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₇H₂₅N₅O₂
Molecular Weight:
331.41
Synonyms:
None
SMILES:
C[C@H](O)[C@H](CC)N1N=CN(C2=CC=C(N3CCNCC3)C=C2)C1=O
Tpsa:
75.32
Logp:
0.7755
H Acceptors:
7
H Donors:
2
Rotatable Bonds:
5
Purity: 97%
MDL No: None
Storage: Store at room temperature
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₄H₂₂N₂O₄
Molecular Weight: 402.44
Synonyms: None
SMILES: O=C(OCC1C2=CC=CC=C2C3=CC=CC=C31)N[C@H](C(O)=O)CCC4=CC=NC=C4
Tpsa: 88.52
Logp: 4.0061
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 7
Purity:
97%
MDL No:
None
Storage:
Store at room temperature
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₄H₂₂N₂O₄
Molecular Weight:
402.44
Synonyms:
None
SMILES:
O=C(OCC1C2=CC=CC=C2C3=CC=CC=C31)N[C@H](C(O)=O)CCC4=CC=NC=C4
Tpsa:
88.52
Logp:
4.0061
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
7
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₁NO₂
Molecular Weight: 177.20
Synonyms: None
SMILES: O=C1O[C@H](C2=CC=CC=C2)[C@@H](C)N1
Tpsa: 38.33
Logp: 1.856
H Acceptors: 2
H Donors: 1
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:
C₁₀H₁₁NO₂
Molecular Weight:
177.20
Synonyms:
None
SMILES:
O=C1O[C@H](C2=CC=CC=C2)[C@@H](C)N1
Tpsa:
38.33
Logp:
1.856
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
1
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₂H₄₁N₃O₈S
Molecular Weight: 507.64
Synonyms: None
SMILES: O=C(NCCCOCCOCCOCCOCC(O)CO)CCCC[C@@H]1SC[C@]([C@]1([H])N2)([H])NC2=O
Tpsa: N/A
Logp: N/A
H Acceptors: N/A
H Donors: N/A
Rotatable Bonds: N/A
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₂H₄₁N₃O₈S
Molecular Weight:
507.64
Synonyms:
None
SMILES:
O=C(NCCCOCCOCCOCCOCC(O)CO)CCCC[C@@H]1SC[C@]([C@]1([H])N2)([H])NC2=O
Tpsa:
N/A
Logp:
N/A
H Acceptors:
N/A
H Donors:
N/A
Rotatable Bonds:
N/A