AE71841
1243461-51-9 | Benzyl 7-bromospiro[indoline-3,4'-piperidine]-1'-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AE71841
ChemicalName
Benzyl 7-bromospiro[indoline-3,4'-piperidine]-1'-carboxylate
CasNumber
1243461-51-9
MolecularFormula
C20H21BrN2O2
MolecularWeight
401.2969
MdlNumber
MFCD15071690
Smiles
O=C(N1CCC2(CC1)CNc1c2cccc1Br)OCc1ccccc1
Complexity
472
Covalently-bondedUnitCount
1
HeavyAtomCount
25
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
4.3
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CatalogNumber: AE71841
ChemicalName: Benzyl 7-bromospiro[indoline-3,4'-piperidine]-1'-carboxylate
CasNumber: 1243461-51-9
MolecularFormula: C20H21BrN2O2
MolecularWeight: 401.2969
MdlNumber: MFCD15071690
Smiles: O=C(N1CCC2(CC1)CNc1c2cccc1Br)OCc1ccccc1
Complexity: 472
Covalently-bondedUnitCount: 1
HeavyAtomCount: 25
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 4.3
CatalogNumber:
AE71841
ChemicalName:
Benzyl 7-bromospiro[indoline-3,4'-piperidine]-1'-carboxylate
CasNumber:
1243461-51-9
MolecularFormula:
C20H21BrN2O2
MolecularWeight:
401.2969
MdlNumber:
MFCD15071690
Smiles:
O=C(N1CCC2(CC1)CNc1c2cccc1Br)OCc1ccccc1
Complexity:
472
Covalently-bondedUnitCount:
1
HeavyAtomCount:
25
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
4.3
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Smiles: O=C1CCC(N1)Cc1ccccc1
Complexity: __
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Smiles:
O=C1CCC(N1)Cc1ccccc1
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Smiles: O=C(c1ccc(cc1)OC1CCNCC1)OCc1ccccc1.Cl
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Smiles:
O=C(c1ccc(cc1)OC1CCNCC1)OCc1ccccc1.Cl
Complexity:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: Brc1cc(ccc1OCCC1CCCNC1)Cc1ccccc1.Cl
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Smiles:
Brc1cc(ccc1OCCC1CCCNC1)Cc1ccccc1.Cl
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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