CS-1062948
(S)-4-(1-Benzyl-2-methyl-4-nitro-1H-imidazol-5-yl)but-3-yn-2-ol
Manufacturer: ChemScene
CAS Number: 2569937-82-0
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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
C₁₅H₁₅N₃O₃
Molecular Weight
285.30
Synonyms
None
SMILES
C(#C[C@H](C)O)C=1N(CC2=CC=CC=C2)C(C)=NC1N(=O)=O
Tpsa
81.19
Logp
1.88032
H Acceptors
5
H Donors
1
Rotatable Bonds
3
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: C₁₅H₁₅N₃O₃
Molecular Weight: 285.30
Synonyms: None
SMILES: C(#C[C@H](C)O)C=1N(CC2=CC=CC=C2)C(C)=NC1N(=O)=O
Tpsa: 81.19
Logp: 1.88032
H Acceptors: 5
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:
C₁₅H₁₅N₃O₃
Molecular Weight:
285.30
Synonyms:
None
SMILES:
C(#C[C@H](C)O)C=1N(CC2=CC=CC=C2)C(C)=NC1N(=O)=O
Tpsa:
81.19
Logp:
1.88032
H Acceptors:
5
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: C₁₄H₁₃NO₃
Molecular Weight: 243.26
Synonyms: None
SMILES: C(OC)(=O)C=1C=2C(NC1)=CC=C(C#C[C@H](C)O)C2
Tpsa: 62.32
Logp: 1.6868
H Acceptors: 3
H Donors: 2
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:
C₁₄H₁₃NO₃
Molecular Weight:
243.26
Synonyms:
None
SMILES:
C(OC)(=O)C=1C=2C(NC1)=CC=C(C#C[C@H](C)O)C2
Tpsa:
62.32
Logp:
1.6868
H Acceptors:
3
H Donors:
2
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: C₇H₅BrN₂O
Molecular Weight: 213.03
Synonyms: None
SMILES: BrC1=NC=CN=C1C#CCO
Tpsa: 46.01
Logp: 0.5829
H Acceptors: 3
H Donors: 1
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:
C₇H₅BrN₂O
Molecular Weight:
213.03
Synonyms:
None
SMILES:
BrC1=NC=CN=C1C#CCO
Tpsa:
46.01
Logp:
0.5829
H Acceptors:
3
H Donors:
1
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: C₁₀H₇NS
Molecular Weight: 173.23
Synonyms: None
SMILES: C(#CC)C=1C=NC=2SC=CC2C1
Tpsa: 12.89
Logp: 2.6677
H Acceptors: 2
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:
C₁₀H₇NS
Molecular Weight:
173.23
Synonyms:
None
SMILES:
C(#CC)C=1C=NC=2SC=CC2C1
Tpsa:
12.89
Logp:
2.6677
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
0