AG32840
5454-97-7 | 2-Nitro-N-phenylbenzenesulfonamide
Manufacturer: A2B Chem
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CatalogNumber
AG32840
ChemicalName
2-Nitro-N-phenylbenzenesulfonamide
CasNumber
5454-97-7
MolecularFormula
C12H10N2O4S
MolecularWeight
278.2838
MdlNumber
MFCD00547842
Smiles
[O-][N+](=O)c1ccccc1S(=O)(=O)Nc1ccccc1
Complexity
406
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
2.3
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CatalogNumber: AG32840
ChemicalName: 2-Nitro-N-phenylbenzenesulfonamide
CasNumber: 5454-97-7
MolecularFormula: C12H10N2O4S
MolecularWeight: 278.2838
MdlNumber: MFCD00547842
Smiles: [O-][N+](=O)c1ccccc1S(=O)(=O)Nc1ccccc1
Complexity: 406
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 2.3
CatalogNumber:
AG32840
ChemicalName:
2-Nitro-N-phenylbenzenesulfonamide
CasNumber:
5454-97-7
MolecularFormula:
C12H10N2O4S
MolecularWeight:
278.2838
MdlNumber:
MFCD00547842
Smiles:
[O-][N+](=O)c1ccccc1S(=O)(=O)Nc1ccccc1
Complexity:
406
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
2.3
CatalogNumber: AG32841
ChemicalName: 2-Fluoro-4-phenylbenzoic acid
CasNumber: 505082-76-8
MolecularFormula: C13H9FO2
MolecularWeight: 216.2078
MdlNumber: MFCD07779362
Smiles: OC(=O)c1ccc(cc1F)c1ccccc1
Complexity: 248
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 3.2
CatalogNumber:
AG32841
ChemicalName:
2-Fluoro-4-phenylbenzoic acid
CasNumber:
505082-76-8
MolecularFormula:
C13H9FO2
MolecularWeight:
216.2078
MdlNumber:
MFCD07779362
Smiles:
OC(=O)c1ccc(cc1F)c1ccccc1
Complexity:
248
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
3.2
CatalogNumber: AG32842
ChemicalName: 1-Methanesulfonylpyrrole
CasNumber: 51832-28-1
MolecularFormula: C5H7NO2S
MolecularWeight: 145.1796
MdlNumber: MFCD05144862
Smiles: CS(=O)(=O)n1cccc1
Complexity: 174
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: 0.3
CatalogNumber:
AG32842
ChemicalName:
1-Methanesulfonylpyrrole
CasNumber:
51832-28-1
MolecularFormula:
C5H7NO2S
MolecularWeight:
145.1796
MdlNumber:
MFCD05144862
Smiles:
CS(=O)(=O)n1cccc1
Complexity:
174
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
0.3
CatalogNumber: AG32843
ChemicalName: (2E)-3-(1-Methyl-1h-pyrrol-2-yl)acrylic acid
CasNumber: 51485-76-8
MolecularFormula: C8H9NO2
MolecularWeight: 151.1626
MdlNumber: MFCD06205254
Smiles: OC(=O)/C=C/c1cccn1C
Complexity: 177
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 0.7
CatalogNumber:
AG32843
ChemicalName:
(2E)-3-(1-Methyl-1h-pyrrol-2-yl)acrylic acid
CasNumber:
51485-76-8
MolecularFormula:
C8H9NO2
MolecularWeight:
151.1626
MdlNumber:
MFCD06205254
Smiles:
OC(=O)/C=C/c1cccn1C
Complexity:
177
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
0.7