AA60198
139261-90-8 | 3-Benzoyl-1-tosylpyrrole
Manufacturer: A2B Chem
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CatalogNumber
AA60198
ChemicalName
3-Benzoyl-1-tosylpyrrole
CasNumber
139261-90-8
MolecularFormula
C18H15NO3S
MolecularWeight
325.3816
MdlNumber
MFCD03411960
Smiles
Cc1ccc(cc1)S(=O)(=O)n1ccc(c1)C(=O)c1ccccc1
Complexity
511
Covalently-bondedUnitCount
1
HeavyAtomCount
23
HydrogenBondAcceptorCount
3
RotatableBondCount
4
Xlogp3
3.6
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CatalogNumber: AA60198
ChemicalName: 3-Benzoyl-1-tosylpyrrole
CasNumber: 139261-90-8
MolecularFormula: C18H15NO3S
MolecularWeight: 325.3816
MdlNumber: MFCD03411960
Smiles: Cc1ccc(cc1)S(=O)(=O)n1ccc(c1)C(=O)c1ccccc1
Complexity: 511
Covalently-bondedUnitCount: 1
HeavyAtomCount: 23
HydrogenBondAcceptorCount: 3
RotatableBondCount: 4
Xlogp3: 3.6
CatalogNumber:
AA60198
ChemicalName:
3-Benzoyl-1-tosylpyrrole
CasNumber:
139261-90-8
MolecularFormula:
C18H15NO3S
MolecularWeight:
325.3816
MdlNumber:
MFCD03411960
Smiles:
Cc1ccc(cc1)S(=O)(=O)n1ccc(c1)C(=O)c1ccccc1
Complexity:
511
Covalently-bondedUnitCount:
1
HeavyAtomCount:
23
HydrogenBondAcceptorCount:
3
RotatableBondCount:
4
Xlogp3:
3.6
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Smiles: CCc1noc(n1)C1CCCNC1
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
CCc1noc(n1)C1CCCNC1
Complexity:
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Covalently-bondedUnitCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: OC(=CC(=O)c1ccc(cc1)Cl)/C(=C/C(=O)c1ccc(cc1)Cl)/O
Complexity: __
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MolecularFormula:
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MolecularWeight:
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Smiles:
OC(=CC(=O)c1ccc(cc1)Cl)/C(=C/C(=O)c1ccc(cc1)Cl)/O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: CN(CCc1c[nH]c2c1cc(CC1COC(=O)N1)cc2)C
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HydrogenBondAcceptorCount: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CN(CCc1c[nH]c2c1cc(CC1COC(=O)N1)cc2)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__