AG36689
53159-71-0 | 1-(2-Amino-1,3-thiazol-5-yl)ethan-1-one
Manufacturer: A2B Chem
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CatalogNumber
AG36689
ChemicalName
1-(2-Amino-1,3-thiazol-5-yl)ethan-1-one
CasNumber
53159-71-0
MolecularFormula
C5H6N2OS
MolecularWeight
142.17894
MdlNumber
MFCD00775044
Smiles
CC(=O)c1cnc(s1)N
Complexity
128
Covalently-bondedUnitCount
1
HeavyAtomCount
9
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
0.6
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CatalogNumber: AG36689
ChemicalName: 1-(2-Amino-1,3-thiazol-5-yl)ethan-1-one
CasNumber: 53159-71-0
MolecularFormula: C5H6N2OS
MolecularWeight: 142.17894
MdlNumber: MFCD00775044
Smiles: CC(=O)c1cnc(s1)N
Complexity: 128
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 0.6
CatalogNumber:
AG36689
ChemicalName:
1-(2-Amino-1,3-thiazol-5-yl)ethan-1-one
CasNumber:
53159-71-0
MolecularFormula:
C5H6N2OS
MolecularWeight:
142.17894
MdlNumber:
MFCD00775044
Smiles:
CC(=O)c1cnc(s1)N
Complexity:
128
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
0.6
CatalogNumber: AG36690
ChemicalName: 5-Amino-2-fluorophenylacetic acid
CasNumber: 518057-74-4
MolecularFormula: C8H8FNO2
MolecularWeight: 169.153
MdlNumber: MFCD03094259
Smiles: Nc1cc(CC(=O)O)c(cc1)F
Complexity: 174
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: 0.8
CatalogNumber:
AG36690
ChemicalName:
5-Amino-2-fluorophenylacetic acid
CasNumber:
518057-74-4
MolecularFormula:
C8H8FNO2
MolecularWeight:
169.153
MdlNumber:
MFCD03094259
Smiles:
Nc1cc(CC(=O)O)c(cc1)F
Complexity:
174
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
0.8
CatalogNumber: __
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Smiles: CNC(=O)CC(N)C
Complexity: __
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Smiles:
CNC(=O)CC(N)C
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RotatableBondCount:
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Smiles: OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1nc(c2c1ncnc2N)Cc1ccccc1
Complexity: __
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Xlogp3: __
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1nc(c2c1ncnc2N)Cc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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