AE65035
1292317-56-6 | tert-Butyl 4-(4-bromo-2-cyanophenoxy)piperidine-1-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AE65035
ChemicalName
tert-Butyl 4-(4-bromo-2-cyanophenoxy)piperidine-1-carboxylate
CasNumber
1292317-56-6
MolecularFormula
C17H21BrN2O3
MolecularWeight
381.2642
MdlNumber
MFCD28142806
Smiles
N#Cc1cc(Br)ccc1OC1CCN(CC1)C(=O)OC(C)(C)C
Complexity
460
Covalently-bondedUnitCount
1
HeavyAtomCount
23
HydrogenBondAcceptorCount
4
RotatableBondCount
4
Xlogp3
3.7
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CatalogNumber: AE65035
ChemicalName: tert-Butyl 4-(4-bromo-2-cyanophenoxy)piperidine-1-carboxylate
CasNumber: 1292317-56-6
MolecularFormula: C17H21BrN2O3
MolecularWeight: 381.2642
MdlNumber: MFCD28142806
Smiles: N#Cc1cc(Br)ccc1OC1CCN(CC1)C(=O)OC(C)(C)C
Complexity: 460
Covalently-bondedUnitCount: 1
HeavyAtomCount: 23
HydrogenBondAcceptorCount: 4
RotatableBondCount: 4
Xlogp3: 3.7
CatalogNumber:
AE65035
ChemicalName:
tert-Butyl 4-(4-bromo-2-cyanophenoxy)piperidine-1-carboxylate
CasNumber:
1292317-56-6
MolecularFormula:
C17H21BrN2O3
MolecularWeight:
381.2642
MdlNumber:
MFCD28142806
Smiles:
N#Cc1cc(Br)ccc1OC1CCN(CC1)C(=O)OC(C)(C)C
Complexity:
460
Covalently-bondedUnitCount:
1
HeavyAtomCount:
23
HydrogenBondAcceptorCount:
4
RotatableBondCount:
4
Xlogp3:
3.7
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Smiles: Clc1ncc(cn1)c1noc(n1)C(F)(F)F
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Clc1ncc(cn1)c1noc(n1)C(F)(F)F
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Smiles: OC(=O)Cc1ccc(cc1)c1noc(n1)C(F)(F)F
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Smiles:
OC(=O)Cc1ccc(cc1)c1noc(n1)C(F)(F)F
Complexity:
__
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__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: COc1ccc(cc1)c1ccc(cc1)c1ccc(cc1)OC
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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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:
COc1ccc(cc1)c1ccc(cc1)c1ccc(cc1)OC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Xlogp3:
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