AF68381
380349-00-8 | 3,4-Diamino-n-(3-trifluoromethyl-phenyl)-benzenesulfonamide
Manufacturer: A2B Chem
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CatalogNumber
AF68381
ChemicalName
3,4-Diamino-n-(3-trifluoromethyl-phenyl)-benzenesulfonamide
CasNumber
380349-00-8
MolecularFormula
C13H12F3N3O2S
MolecularWeight
331.3135
MdlNumber
MFCD03150306
Smiles
Nc1cc(ccc1N)S(=O)(=O)Nc1cccc(c1)C(F)(F)F
Complexity
478
Covalently-bondedUnitCount
1
HeavyAtomCount
22
HydrogenBondAcceptorCount
8
HydrogenBondDonorCount
3
RotatableBondCount
3
Xlogp3
2
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CatalogNumber: AF68381
ChemicalName: 3,4-Diamino-n-(3-trifluoromethyl-phenyl)-benzenesulfonamide
CasNumber: 380349-00-8
MolecularFormula: C13H12F3N3O2S
MolecularWeight: 331.3135
MdlNumber: MFCD03150306
Smiles: Nc1cc(ccc1N)S(=O)(=O)Nc1cccc(c1)C(F)(F)F
Complexity: 478
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 8
HydrogenBondDonorCount: 3
RotatableBondCount: 3
Xlogp3: 2
CatalogNumber:
AF68381
ChemicalName:
3,4-Diamino-n-(3-trifluoromethyl-phenyl)-benzenesulfonamide
CasNumber:
380349-00-8
MolecularFormula:
C13H12F3N3O2S
MolecularWeight:
331.3135
MdlNumber:
MFCD03150306
Smiles:
Nc1cc(ccc1N)S(=O)(=O)Nc1cccc(c1)C(F)(F)F
Complexity:
478
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
8
HydrogenBondDonorCount:
3
RotatableBondCount:
3
Xlogp3:
2
CatalogNumber: __
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Smiles: O=C1N=c2ccc(cc2=C(C1)C(F)(F)F)[N+](=O)[O-]
Complexity: __
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HydrogenBondAcceptorCount: __
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RotatableBondCount: __
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Smiles:
O=C1N=c2ccc(cc2=C(C1)C(F)(F)F)[N+](=O)[O-]
Complexity:
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RotatableBondCount:
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Smiles: Cc1nc2ccccc2c2c1cccc2
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Smiles:
Cc1nc2ccccc2c2c1cccc2
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: O=Cc1nnnn1C
Complexity: __
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HydrogenBondDonorCount: __
RotatableBondCount: __
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:
O=Cc1nnnn1C
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__