AA08840
1022353-79-2 | Ethyl 2-(4-(4-bromophenylsulfonyl)piperazinoacetate
Manufacturer: A2B Chem
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CatalogNumber
AA08840
ChemicalName
Ethyl 2-(4-(4-bromophenylsulfonyl)piperazinoacetate
CasNumber
1022353-79-2
MolecularFormula
C14H19BrN2O4S
MolecularWeight
391.2807
MdlNumber
MFCD12913973
Smiles
CCOC(=O)CN1CCN(CC1)S(=O)(=O)c1ccc(cc1)Br
Complexity
464
Covalently-bondedUnitCount
1
HeavyAtomCount
22
HydrogenBondAcceptorCount
6
RotatableBondCount
6
Xlogp3
1.9
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CatalogNumber: AA08840
ChemicalName: Ethyl 2-(4-(4-bromophenylsulfonyl)piperazinoacetate
CasNumber: 1022353-79-2
MolecularFormula: C14H19BrN2O4S
MolecularWeight: 391.2807
MdlNumber: MFCD12913973
Smiles: CCOC(=O)CN1CCN(CC1)S(=O)(=O)c1ccc(cc1)Br
Complexity: 464
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 6
RotatableBondCount: 6
Xlogp3: 1.9
CatalogNumber:
AA08840
ChemicalName:
Ethyl 2-(4-(4-bromophenylsulfonyl)piperazinoacetate
CasNumber:
1022353-79-2
MolecularFormula:
C14H19BrN2O4S
MolecularWeight:
391.2807
MdlNumber:
MFCD12913973
Smiles:
CCOC(=O)CN1CCN(CC1)S(=O)(=O)c1ccc(cc1)Br
Complexity:
464
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
6
RotatableBondCount:
6
Xlogp3:
1.9
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Smiles: Cc1cc(Br)c(c(n1)[N+](=O)[O-])O
Complexity: __
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Smiles:
Cc1cc(Br)c(c(n1)[N+](=O)[O-])O
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Smiles: COc1ccc(cc1Br)N(C)C
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Smiles:
COc1ccc(cc1Br)N(C)C
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RotatableBondCount:
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Smiles: CCc1cc2c(o1)c(OC)ccc2
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__
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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Smiles:
CCc1cc2c(o1)c(OC)ccc2
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
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