AF02413
194853-66-2 | tert-Butyl 4-[(4-fluorobenzene)sulfonyl]piperazine-1-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AF02413
ChemicalName
tert-Butyl 4-[(4-fluorobenzene)sulfonyl]piperazine-1-carboxylate
CasNumber
194853-66-2
MolecularFormula
C15H21FN2O4S
MolecularWeight
344.4016
MdlNumber
MFCD03943805
Smiles
O=C(N1CCN(CC1)S(=O)(=O)c1ccc(cc1)F)OC(C)(C)C
Complexity
511
Covalently-bondedUnitCount
1
HeavyAtomCount
23
HydrogenBondAcceptorCount
6
RotatableBondCount
4
Xlogp3
1.8
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CatalogNumber: AF02413
ChemicalName: tert-Butyl 4-[(4-fluorobenzene)sulfonyl]piperazine-1-carboxylate
CasNumber: 194853-66-2
MolecularFormula: C15H21FN2O4S
MolecularWeight: 344.4016
MdlNumber: MFCD03943805
Smiles: O=C(N1CCN(CC1)S(=O)(=O)c1ccc(cc1)F)OC(C)(C)C
Complexity: 511
Covalently-bondedUnitCount: 1
HeavyAtomCount: 23
HydrogenBondAcceptorCount: 6
RotatableBondCount: 4
Xlogp3: 1.8
CatalogNumber:
AF02413
ChemicalName:
tert-Butyl 4-[(4-fluorobenzene)sulfonyl]piperazine-1-carboxylate
CasNumber:
194853-66-2
MolecularFormula:
C15H21FN2O4S
MolecularWeight:
344.4016
MdlNumber:
MFCD03943805
Smiles:
O=C(N1CCN(CC1)S(=O)(=O)c1ccc(cc1)F)OC(C)(C)C
Complexity:
511
Covalently-bondedUnitCount:
1
HeavyAtomCount:
23
HydrogenBondAcceptorCount:
6
RotatableBondCount:
4
Xlogp3:
1.8
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Smiles: O=C(N1CCC(CC1)Nc1nccc(c1)I)OC(C)(C)C
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Smiles:
O=C(N1CCC(CC1)Nc1nccc(c1)I)OC(C)(C)C
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Smiles: Brc1ccc(c(c1)S(=O)(=O)N1CCN(CC1)C(=O)OC(C)(C)C)OC(F)(F)F
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Smiles:
Brc1ccc(c(c1)S(=O)(=O)N1CCN(CC1)C(=O)OC(C)(C)C)OC(F)(F)F
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__
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Smiles: COc1ccc(cc1S(=O)(=O)N1CCN(CC1)C(=O)OC(C)(C)C)Br
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Smiles:
COc1ccc(cc1S(=O)(=O)N1CCN(CC1)C(=O)OC(C)(C)C)Br
Complexity:
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Covalently-bondedUnitCount:
__
HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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