AB64273
45534-08-5 | 3-Amino-5-methylthio-1h-1,2,4-triazole
Manufacturer: A2B Chem
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CatalogNumber
AB64273
ChemicalName
3-Amino-5-methylthio-1h-1,2,4-triazole
CasNumber
45534-08-5
MolecularFormula
C3H6N4S
MolecularWeight
130.17154
MdlNumber
MFCD00005232
Smiles
CSc1nnc([nH]1)N
NscNumber
178858
Complexity
77.7
Covalently-bondedUnitCount
1
HeavyAtomCount
8
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
1
Xlogp3
0.5
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CatalogNumber: AB64273
ChemicalName: 3-Amino-5-methylthio-1h-1,2,4-triazole
CasNumber: 45534-08-5
MolecularFormula: C3H6N4S
MolecularWeight: 130.17154
MdlNumber: MFCD00005232
Smiles: CSc1nnc([nH]1)N
NscNumber: 178858
Complexity: 77.7
Covalently-bondedUnitCount: 1
HeavyAtomCount: 8
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 0.5
CatalogNumber:
AB64273
ChemicalName:
3-Amino-5-methylthio-1h-1,2,4-triazole
CasNumber:
45534-08-5
MolecularFormula:
C3H6N4S
MolecularWeight:
130.17154
MdlNumber:
MFCD00005232
Smiles:
CSc1nnc([nH]1)N
NscNumber:
178858
Complexity:
77.7
Covalently-bondedUnitCount:
1
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
0.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
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Smiles: Nc1cc(cc(c1)C(F)(F)F)[N+](=O)[O-]
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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RotatableBondCount: __
Xlogp3: __
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Smiles:
Nc1cc(cc(c1)C(F)(F)F)[N+](=O)[O-]
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Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
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RotatableBondCount:
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Xlogp3:
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CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: ClCc1c[n+]([O-])c(c(n1)C#N)N
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
ClCc1c[n+]([O-])c(c(n1)C#N)N
NscNumber:
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Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
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MolecularFormula: __
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MdlNumber: __
Smiles: Fc1ccc2c(c1F)[nH]nc2N
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
Fc1ccc2c(c1F)[nH]nc2N
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__