CS-0748430
(2S)-2-[[2-(2-Methyl-1H-indol-3-yl)acetyl]amino]-3-phenylpropanoic acid
Manufacturer: ChemScene
CAS Number: 2452149-81-2
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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
C₂₀H₂₀N₂O₃
Molecular Weight
336.38
Synonyms
None
SMILES
CC1=C(CC(=O)N[C@@H](CC2=CC=CC=C2)C(O)=O)C2=CC=CC=C2N1
Tpsa
82.19
Logp
2.83092
H Acceptors
2
H Donors
3
Rotatable Bonds
6
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: C₂₀H₂₀N₂O₃
Molecular Weight: 336.38
Synonyms: None
SMILES: CC1=C(CC(=O)N[C@@H](CC2=CC=CC=C2)C(O)=O)C2=CC=CC=C2N1
Tpsa: 82.19
Logp: 2.83092
H Acceptors: 2
H Donors: 3
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₂₀N₂O₃
Molecular Weight:
336.38
Synonyms:
None
SMILES:
CC1=C(CC(=O)N[C@@H](CC2=CC=CC=C2)C(O)=O)C2=CC=CC=C2N1
Tpsa:
82.19
Logp:
2.83092
H Acceptors:
2
H Donors:
3
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₂N₂O₄
Molecular Weight: 248.23
Synonyms: None
SMILES: CCOC(=O)C1=CC2=C(C(C)=CC=C2N1)[N+]([O-])=O
Tpsa: 85.23
Logp: 2.56122
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:
C₁₂H₁₂N₂O₄
Molecular Weight:
248.23
Synonyms:
None
SMILES:
CCOC(=O)C1=CC2=C(C(C)=CC=C2N1)[N+]([O-])=O
Tpsa:
85.23
Logp:
2.56122
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
3
Purity: 96%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₂ClNO₂S
Molecular Weight: 257.74
Synonyms: None
SMILES: Cl.N[C@@H](CC1=CSC2=CC=CC=C12)C(O)=O
Tpsa: 63.32
Logp: 2.2775
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 3
Purity:
96%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₂ClNO₂S
Molecular Weight:
257.74
Synonyms:
None
SMILES:
Cl.N[C@@H](CC1=CSC2=CC=CC=C12)C(O)=O
Tpsa:
63.32
Logp:
2.2775
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
3
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₇NO₄
Molecular Weight: 251.28
Synonyms: None
SMILES: OC[C@@H](NC(=O)OCC1=CC=CC=C1)C1(O)CC1
Tpsa: 78.79
Logp: 0.7986
H Acceptors: 4
H Donors: 3
Rotatable Bonds: 5
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₇NO₄
Molecular Weight:
251.28
Synonyms:
None
SMILES:
OC[C@@H](NC(=O)OCC1=CC=CC=C1)C1(O)CC1
Tpsa:
78.79
Logp:
0.7986
H Acceptors:
4
H Donors:
3
Rotatable Bonds:
5