CS-0552641
Methyl (2-((3-amino-1H-1,2,4-triazol-5-yl)thio)acetyl)-L-phenylalaninate
Manufacturer: ChemScene
CAS Number: 1009527-42-7
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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
C₁₄H₁₇N₅O₃S
Molecular Weight
335.38
Synonyms
None
SMILES
O=C(OC)[C@H](CC1=CC=CC=C1)NC(CSC2=NC(N)=NN2)=O
Tpsa
122.99
Logp
0.3795
H Acceptors
7
H Donors
3
Rotatable Bonds
7
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 1009527-42-7 | methyl N-{[(3-amino-1H-1,2,4-triazol-5-yl)sulfanyl]acetyl}phenylalaninate | 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: C₁₄H₁₇N₅O₃S
Molecular Weight: 335.38
Synonyms: None
SMILES: O=C(OC)[C@H](CC1=CC=CC=C1)NC(CSC2=NC(N)=NN2)=O
Tpsa: 122.99
Logp: 0.3795
H Acceptors: 7
H Donors: 3
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:
C₁₄H₁₇N₅O₃S
Molecular Weight:
335.38
Synonyms:
None
SMILES:
O=C(OC)[C@H](CC1=CC=CC=C1)NC(CSC2=NC(N)=NN2)=O
Tpsa:
122.99
Logp:
0.3795
H Acceptors:
7
H Donors:
3
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: C₁₅H₁₂N₂O₂
Molecular Weight: 252.27
Synonyms: methyl 4-(1H-benzimidazol-2-yl)benzoate
SMILES: O=C(OC)C1=CC=C(C2=NC3=CC=CC=C3N2)C=C1
Tpsa: 54.98
Logp: 3.0165
H Acceptors: 3
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:
C₁₅H₁₂N₂O₂
Molecular Weight:
252.27
Synonyms:
methyl 4-(1H-benzimidazol-2-yl)benzoate
SMILES:
O=C(OC)C1=CC=C(C2=NC3=CC=CC=C3N2)C=C1
Tpsa:
54.98
Logp:
3.0165
H Acceptors:
3
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: C₉H₁₁N₅O₂
Molecular Weight: 221.22
Synonyms: methyl 1-[(3-amino-1H-pyrazol-1-yl)methyl]-1H-pyrazole-4-carboxylate
SMILES: COC(=O)C1=CN(N=C1)CN2C=CC(=N2)N
Tpsa: 87.96
Logp: -0.0458
H Acceptors: 7
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:
C₉H₁₁N₅O₂
Molecular Weight:
221.22
Synonyms:
methyl 1-[(3-amino-1H-pyrazol-1-yl)methyl]-1H-pyrazole-4-carboxylate
SMILES:
COC(=O)C1=CN(N=C1)CN2C=CC(=N2)N
Tpsa:
87.96
Logp:
-0.0458
H Acceptors:
7
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: C₁₀H₁₈N₄O
Molecular Weight: 210.28
Synonyms: None
SMILES: CCCCNC(=O)C1=C(C=NN1CC)N
Tpsa: 72.94
Logp: 1.0151
H Acceptors: 4
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:
C₁₀H₁₈N₄O
Molecular Weight:
210.28
Synonyms:
None
SMILES:
CCCCNC(=O)C1=C(C=NN1CC)N
Tpsa:
72.94
Logp:
1.0151
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
5