AI60103
897445-35-1 | tert-Butyl 4-(4-chlorobenzoyl)piperazine-1-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AI60103
ChemicalName
tert-Butyl 4-(4-chlorobenzoyl)piperazine-1-carboxylate
CasNumber
897445-35-1
MolecularFormula
C16H21ClN2O3
MolecularWeight
324.8025
MdlNumber
MFCD16620800
Smiles
O=C(c1ccc(cc1)Cl)N1CCN(CC1)C(=O)OC(C)(C)C
Complexity
406
Covalently-bondedUnitCount
1
HeavyAtomCount
22
HydrogenBondAcceptorCount
3
RotatableBondCount
3
Xlogp3
2.7
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CatalogNumber: AI60103
ChemicalName: tert-Butyl 4-(4-chlorobenzoyl)piperazine-1-carboxylate
CasNumber: 897445-35-1
MolecularFormula: C16H21ClN2O3
MolecularWeight: 324.8025
MdlNumber: MFCD16620800
Smiles: O=C(c1ccc(cc1)Cl)N1CCN(CC1)C(=O)OC(C)(C)C
Complexity: 406
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: 2.7
CatalogNumber:
AI60103
ChemicalName:
tert-Butyl 4-(4-chlorobenzoyl)piperazine-1-carboxylate
CasNumber:
897445-35-1
MolecularFormula:
C16H21ClN2O3
MolecularWeight:
324.8025
MdlNumber:
MFCD16620800
Smiles:
O=C(c1ccc(cc1)Cl)N1CCN(CC1)C(=O)OC(C)(C)C
Complexity:
406
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
2.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: OC(=O)c1cc(nc2c1cccc2F)c1cccc(c1)C(F)(F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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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:
OC(=O)c1cc(nc2c1cccc2F)c1cccc(c1)C(F)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
__
CatalogNumber: AI60105
ChemicalName: 2-Aminoethanesulfonamide, HCl
CasNumber: 89756-60-5
MolecularFormula: C2H9ClN2O2S
MolecularWeight: 160.6231
MdlNumber: MFCD02258341
Smiles: NCCS(=O)(=O)N.Cl
Complexity: 121
Covalently-bondedUnitCount: 2
HeavyAtomCount: 8
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: __
CatalogNumber:
AI60105
ChemicalName:
2-Aminoethanesulfonamide, HCl
CasNumber:
89756-60-5
MolecularFormula:
C2H9ClN2O2S
MolecularWeight:
160.6231
MdlNumber:
MFCD02258341
Smiles:
NCCS(=O)(=O)N.Cl
Complexity:
121
Covalently-bondedUnitCount:
2
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C1=CC(=CC(=C1)C(F)(F)F)C2=NC3=C(C=C(C=C3)F)C(=C2)C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C1=CC(=CC(=C1)C(F)(F)F)C2=NC3=C(C=C(C=C3)F)C(=C2)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__