CS-0730322
4-(2-(Cyclohex-1-en-1-yl)ethyl)-5-(pyridin-4-yl)-4H-1,2,4-triazole-3-thiol
Manufacturer: ChemScene
CAS Number: 917746-25-9
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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
C₁₅H₁₈N₄S
Molecular Weight
286.40
Synonyms
None
SMILES
S=C1NN=C(N1CCC1=CCCCC1)C1=CC=NC=C1
Tpsa
46.5
Logp
3.89319
H Acceptors
4
H Donors
1
Rotatable Bonds
4
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: C₁₅H₁₈N₄S
Molecular Weight: 286.40
Synonyms: None
SMILES: S=C1NN=C(N1CCC1=CCCCC1)C1=CC=NC=C1
Tpsa: 46.5
Logp: 3.89319
H Acceptors: 4
H Donors: 1
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:
C₁₅H₁₈N₄S
Molecular Weight:
286.40
Synonyms:
None
SMILES:
S=C1NN=C(N1CCC1=CCCCC1)C1=CC=NC=C1
Tpsa:
46.5
Logp:
3.89319
H Acceptors:
4
H Donors:
1
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: C₁₅H₁₃N₃OS
Molecular Weight: 283.35
Synonyms: None
SMILES: COC1=CC=CC(=C1)N1C(=S)NN=C1C1=CC=CC=C1
Tpsa: 42.84
Logp: 3.60549
H Acceptors: 4
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:
C₁₅H₁₃N₃OS
Molecular Weight:
283.35
Synonyms:
None
SMILES:
COC1=CC=CC(=C1)N1C(=S)NN=C1C1=CC=CC=C1
Tpsa:
42.84
Logp:
3.60549
H Acceptors:
4
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: C₁₆H₁₅N₃O₂S
Molecular Weight: 313.37
Synonyms: None
SMILES: COC1=CC=C(C=C1)N1C(=S)NN=C1COC1=CC=CC=C1
Tpsa: 52.07
Logp: 3.51749
H Acceptors: 5
H Donors: 1
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:
C₁₆H₁₅N₃O₂S
Molecular Weight:
313.37
Synonyms:
None
SMILES:
COC1=CC=C(C=C1)N1C(=S)NN=C1COC1=CC=CC=C1
Tpsa:
52.07
Logp:
3.51749
H Acceptors:
5
H Donors:
1
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: C₁₃H₁₄ClN
Molecular Weight: 219.71
Synonyms: None
SMILES: CCC1=CC2=CC=C(C)C(C)=C2N=C1Cl
Tpsa: 12.89
Logp: 4.06744
H Acceptors: 1
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:
C₁₃H₁₄ClN
Molecular Weight:
219.71
Synonyms:
None
SMILES:
CCC1=CC2=CC=C(C)C(C)=C2N=C1Cl
Tpsa:
12.89
Logp:
4.06744
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
1