AH21522
7385-16-2 | 3-(Butylsulfamoyl)benzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AH21522
ChemicalName
3-(Butylsulfamoyl)benzoic acid
CasNumber
7385-16-2
MolecularFormula
C11H15NO4S
MolecularWeight
257.3061
MdlNumber
MFCD09041593
Smiles
CCCCNS(=O)(=O)c1cccc(c1)C(=O)O
Complexity
347
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
6
Xlogp3
1.7
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CatalogNumber: AH21522
ChemicalName: 3-(Butylsulfamoyl)benzoic acid
CasNumber: 7385-16-2
MolecularFormula: C11H15NO4S
MolecularWeight: 257.3061
MdlNumber: MFCD09041593
Smiles: CCCCNS(=O)(=O)c1cccc(c1)C(=O)O
Complexity: 347
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 6
Xlogp3: 1.7
CatalogNumber:
AH21522
ChemicalName:
3-(Butylsulfamoyl)benzoic acid
CasNumber:
7385-16-2
MolecularFormula:
C11H15NO4S
MolecularWeight:
257.3061
MdlNumber:
MFCD09041593
Smiles:
CCCCNS(=O)(=O)c1cccc(c1)C(=O)O
Complexity:
347
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
6
Xlogp3:
1.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Fc1ccc(cc1)c1ccc(c(c1)O)C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Fc1ccc(cc1)c1ccc(c(c1)O)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CN1CNC(=NC1)S
Complexity: 93.5
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CN1CNC(=NC1)S
Complexity:
93.5
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AH21525
ChemicalName: 7-(Trifluoromethyl)-3,4-dihydro-1H-quinoxalin-2-one
CasNumber: 716-81-4
MolecularFormula: C9H7F3N2O
MolecularWeight: 216.1599
MdlNumber: MFCD01435942
Smiles: O=C1CNc2c(N1)cc(cc2)C(F)(F)F
Complexity: 267
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: __
Xlogp3: 1.8
CatalogNumber:
AH21525
ChemicalName:
7-(Trifluoromethyl)-3,4-dihydro-1H-quinoxalin-2-one
CasNumber:
716-81-4
MolecularFormula:
C9H7F3N2O
MolecularWeight:
216.1599
MdlNumber:
MFCD01435942
Smiles:
O=C1CNc2c(N1)cc(cc2)C(F)(F)F
Complexity:
267
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
__
Xlogp3:
1.8