AB56643
3696-22-8 | 1-(4-Nitrophenyl)-2-thiourea
Manufacturer: A2B Chem
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CatalogNumber
AB56643
ChemicalName
1-(4-Nitrophenyl)-2-thiourea
CasNumber
3696-22-8
MolecularFormula
C7H7N3O2S
MolecularWeight
197.2144
MdlNumber
MFCD00007304
Smiles
NC(=S)Nc1ccc(cc1)[N+](=O)[O-]
NscNumber
61006
Complexity
208
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
1
Xlogp3
1.7
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CatalogNumber: AB56643
ChemicalName: 1-(4-Nitrophenyl)-2-thiourea
CasNumber: 3696-22-8
MolecularFormula: C7H7N3O2S
MolecularWeight: 197.2144
MdlNumber: MFCD00007304
Smiles: NC(=S)Nc1ccc(cc1)[N+](=O)[O-]
NscNumber: 61006
Complexity: 208
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 1.7
CatalogNumber:
AB56643
ChemicalName:
1-(4-Nitrophenyl)-2-thiourea
CasNumber:
3696-22-8
MolecularFormula:
C7H7N3O2S
MolecularWeight:
197.2144
MdlNumber:
MFCD00007304
Smiles:
NC(=S)Nc1ccc(cc1)[N+](=O)[O-]
NscNumber:
61006
Complexity:
208
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
1.7
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Smiles: O=C(c1ccc(cc1)[N+](=O)[O-])/C=C/c1cccs1
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
O=C(c1ccc(cc1)[N+](=O)[O-])/C=C/c1cccs1
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Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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RotatableBondCount:
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Smiles: CC(=NNc1ccccc1)/N=N/c1ccc(cc1)N(=O)=O
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Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
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Xlogp3: __
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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:
CC(=NNc1ccccc1)/N=N/c1ccc(cc1)N(=O)=O
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Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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MolecularFormula: __
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Smiles: Cc1cc(=O)n([nH]1)c1ccc(cc1)[N+](=O)[O-]
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
Cc1cc(=O)n([nH]1)c1ccc(cc1)[N+](=O)[O-]
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__