AI40325
1820618-28-7 | N-Butyl-N-(3-nitrophenyl)methanesulfonamide
Manufacturer: A2B Chem
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CatalogNumber
AI40325
ChemicalName
N-Butyl-N-(3-nitrophenyl)methanesulfonamide
CasNumber
1820618-28-7
MolecularFormula
C11H16N2O4S
MolecularWeight
272.3207
MdlNumber
MFCD28122684
Smiles
CCCCN(S(=O)(=O)C)c1cccc(c1)[N+](=O)[O-]
Complexity
372
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
5
RotatableBondCount
5
Xlogp3
2.2
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CatalogNumber: AI40325
ChemicalName: N-Butyl-N-(3-nitrophenyl)methanesulfonamide
CasNumber: 1820618-28-7
MolecularFormula: C11H16N2O4S
MolecularWeight: 272.3207
MdlNumber: MFCD28122684
Smiles: CCCCN(S(=O)(=O)C)c1cccc(c1)[N+](=O)[O-]
Complexity: 372
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 5
RotatableBondCount: 5
Xlogp3: 2.2
CatalogNumber:
AI40325
ChemicalName:
N-Butyl-N-(3-nitrophenyl)methanesulfonamide
CasNumber:
1820618-28-7
MolecularFormula:
C11H16N2O4S
MolecularWeight:
272.3207
MdlNumber:
MFCD28122684
Smiles:
CCCCN(S(=O)(=O)C)c1cccc(c1)[N+](=O)[O-]
Complexity:
372
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
5
RotatableBondCount:
5
Xlogp3:
2.2
CatalogNumber: AI40326
ChemicalName: N-Cyclopropyl-5-ethoxy-2-nitroaniline
CasNumber: 1820618-34-5
MolecularFormula: C11H14N2O3
MolecularWeight: 222.2405
MdlNumber: MFCD28101657
Smiles: CCOc1ccc(c(c1)NC1CC1)[N+](=O)[O-]
Complexity: 250
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
RotatableBondCount: 4
Xlogp3: 3.2
CatalogNumber:
AI40326
ChemicalName:
N-Cyclopropyl-5-ethoxy-2-nitroaniline
CasNumber:
1820618-34-5
MolecularFormula:
C11H14N2O3
MolecularWeight:
222.2405
MdlNumber:
MFCD28101657
Smiles:
CCOc1ccc(c(c1)NC1CC1)[N+](=O)[O-]
Complexity:
250
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
RotatableBondCount:
4
Xlogp3:
3.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1cc(cc(c1)C(=O)OC)c1ccc2c(c1)OCO2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
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:
COc1cc(cc(c1)C(=O)OC)c1ccc2c(c1)OCO2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Fc1ccc2n(c1)nc(n2)Br
Complexity: 157
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 1.9
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Fc1ccc2n(c1)nc(n2)Br
Complexity:
157
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
1.9