CS-0544896
2-(2,5-Dimethyl-1H-pyrrol-1-yl)-3-(1H-indol-3-yl)propanoic acid
Manufacturer: ChemScene
CAS Number: 625410-16-4
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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
C₁₇H₁₈N₂O₂
Molecular Weight
282.34
Synonyms
2-(2,5-dimethylpyrrol-1-yl)-3-(1H-indol-3-yl)propanoic acid
SMILES
CC1=CC=C(N1C(CC2=CNC3=CC=CC=C32)C(=O)O)C
Tpsa
58.02
Logp
3.45464
H Acceptors
2
H Donors
2
Rotatable Bonds
4
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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: C₁₇H₁₈N₂O₂
Molecular Weight: 282.34
Synonyms: 2-(2,5-dimethylpyrrol-1-yl)-3-(1H-indol-3-yl)propanoic acid
SMILES: CC1=CC=C(N1C(CC2=CNC3=CC=CC=C32)C(=O)O)C
Tpsa: 58.02
Logp: 3.45464
H Acceptors: 2
H Donors: 2
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:
C₁₇H₁₈N₂O₂
Molecular Weight:
282.34
Synonyms:
2-(2,5-dimethylpyrrol-1-yl)-3-(1H-indol-3-yl)propanoic acid
SMILES:
CC1=CC=C(N1C(CC2=CNC3=CC=CC=C32)C(=O)O)C
Tpsa:
58.02
Logp:
3.45464
H Acceptors:
2
H Donors:
2
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: C₁₂H₁₃N₃O₃S
Molecular Weight: 279.31
Synonyms: Ethyl 2-[(4-oxo-4H-pyrido[1,2-a][1,3,5]triazin-2-yl)sulfanyl]propanoate
SMILES: CCOC(=O)C(C)SC1=NC(=O)N2C=CC=CC2=N1
Tpsa: 73.56
Logp: 1.1332
H Acceptors: 7
H Donors: 0
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:
C₁₂H₁₃N₃O₃S
Molecular Weight:
279.31
Synonyms:
Ethyl 2-[(4-oxo-4H-pyrido[1,2-a][1,3,5]triazin-2-yl)sulfanyl]propanoate
SMILES:
CCOC(=O)C(C)SC1=NC(=O)N2C=CC=CC2=N1
Tpsa:
73.56
Logp:
1.1332
H Acceptors:
7
H Donors:
0
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: C₁₂H₁₀ClNO₂
Molecular Weight: 235.67
Synonyms: 6-CHLORO-5-(4-METHYLPHENYL)-2,4-PYRIDINEDIOL
SMILES: OC1=NC(Cl)=C(C2=CC=C(C)C=C2)C(O)=C1
Tpsa: 53.35
Logp: 3.12162
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:
C₁₂H₁₀ClNO₂
Molecular Weight:
235.67
Synonyms:
6-CHLORO-5-(4-METHYLPHENYL)-2,4-PYRIDINEDIOL
SMILES:
OC1=NC(Cl)=C(C2=CC=C(C)C=C2)C(O)=C1
Tpsa:
53.35
Logp:
3.12162
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: C₁₂H₁₃N₃O
Molecular Weight: 215.25
Synonyms: [4-(5,6-dihydro-8H-imidazo[2,1-c][1,4]oxazin-3-yl)phenyl]amine
SMILES: C1COCC2=NC=C(N21)C3=CC=C(C=C3)N
Tpsa: 53.07
Logp: 1.6625
H Acceptors: 4
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:
C₁₂H₁₃N₃O
Molecular Weight:
215.25
Synonyms:
[4-(5,6-dihydro-8H-imidazo[2,1-c][1,4]oxazin-3-yl)phenyl]amine
SMILES:
C1COCC2=NC=C(N21)C3=CC=C(C=C3)N
Tpsa:
53.07
Logp:
1.6625
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
1