AG79672
61996-32-5 | 2-Acetamido-5-methylthiazole
Manufacturer: A2B Chem
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CatalogNumber
AG79672
ChemicalName
2-Acetamido-5-methylthiazole
CasNumber
61996-32-5
MolecularFormula
C6H8N2OS
MolecularWeight
156.2055
MdlNumber
MFCD18801061
Smiles
CC(=O)Nc1ncc(s1)C
NscNumber
170683
Complexity
140
Covalently-bondedUnitCount
1
HeavyAtomCount
10
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
0.9
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CatalogNumber: AG79672
ChemicalName: 2-Acetamido-5-methylthiazole
CasNumber: 61996-32-5
MolecularFormula: C6H8N2OS
MolecularWeight: 156.2055
MdlNumber: MFCD18801061
Smiles: CC(=O)Nc1ncc(s1)C
NscNumber: 170683
Complexity: 140
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 0.9
CatalogNumber:
AG79672
ChemicalName:
2-Acetamido-5-methylthiazole
CasNumber:
61996-32-5
MolecularFormula:
C6H8N2OS
MolecularWeight:
156.2055
MdlNumber:
MFCD18801061
Smiles:
CC(=O)Nc1ncc(s1)C
NscNumber:
170683
Complexity:
140
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
0.9
CatalogNumber: AG79673
ChemicalName: 2-Bromo-4-fluoro-5-nitrotoluene
CasNumber: 64695-96-1
MolecularFormula: C7H5BrFNO2
MolecularWeight: 234.0225
MdlNumber: MFCD11847636
Smiles: [O-][N+](=O)c1cc(C)c(cc1F)Br
NscNumber: __
Complexity: 185
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.9
CatalogNumber:
AG79673
ChemicalName:
2-Bromo-4-fluoro-5-nitrotoluene
CasNumber:
64695-96-1
MolecularFormula:
C7H5BrFNO2
MolecularWeight:
234.0225
MdlNumber:
MFCD11847636
Smiles:
[O-][N+](=O)c1cc(C)c(cc1F)Br
NscNumber:
__
Complexity:
185
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.9
CatalogNumber: AG79674
ChemicalName: Ethyl 4-(4-nitrophenyl)benzoate
CasNumber: 6242-99-5
MolecularFormula: C15H13NO4
MolecularWeight: 271.268
MdlNumber: MFCD00428166
Smiles: CCOC(=O)c1ccc(cc1)c1ccc(cc1)[N+](=O)[O-]
NscNumber: __
Complexity: 336
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 4
Xlogp3: 4
CatalogNumber:
AG79674
ChemicalName:
Ethyl 4-(4-nitrophenyl)benzoate
CasNumber:
6242-99-5
MolecularFormula:
C15H13NO4
MolecularWeight:
271.268
MdlNumber:
MFCD00428166
Smiles:
CCOC(=O)c1ccc(cc1)c1ccc(cc1)[N+](=O)[O-]
NscNumber:
__
Complexity:
336
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
4
Xlogp3:
4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NCCn1c(C)nc2c1cccc2.Cl
NscNumber: __
Complexity: 172
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 0.8
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NCCn1c(C)nc2c1cccc2.Cl
NscNumber:
__
Complexity:
172
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
0.8