AI50802
473737-34-7 | Benzyl 4-bromospiro[indoline-3,4'-piperidine]-1'-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AI50802
ChemicalName
Benzyl 4-bromospiro[indoline-3,4'-piperidine]-1'-carboxylate
CasNumber
473737-34-7
MolecularFormula
C20H21BrN2O2
MolecularWeight
401.2969
MdlNumber
MFCD11975882
Smiles
O=C(N1CCC2(CC1)CNc1c2c(Br)ccc1)OCc1ccccc1
Complexity
472
Covalently-bondedUnitCount
1
HeavyAtomCount
25
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
4.3
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CatalogNumber: AI50802
ChemicalName: Benzyl 4-bromospiro[indoline-3,4'-piperidine]-1'-carboxylate
CasNumber: 473737-34-7
MolecularFormula: C20H21BrN2O2
MolecularWeight: 401.2969
MdlNumber: MFCD11975882
Smiles: O=C(N1CCC2(CC1)CNc1c2c(Br)ccc1)OCc1ccccc1
Complexity: 472
Covalently-bondedUnitCount: 1
HeavyAtomCount: 25
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 4.3
CatalogNumber:
AI50802
ChemicalName:
Benzyl 4-bromospiro[indoline-3,4'-piperidine]-1'-carboxylate
CasNumber:
473737-34-7
MolecularFormula:
C20H21BrN2O2
MolecularWeight:
401.2969
MdlNumber:
MFCD11975882
Smiles:
O=C(N1CCC2(CC1)CNc1c2c(Br)ccc1)OCc1ccccc1
Complexity:
472
Covalently-bondedUnitCount:
1
HeavyAtomCount:
25
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
4.3
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Smiles: OC(=O)C(F)(F)F.N#C[C@@H]1CCCN1
Complexity: __
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Smiles:
OC(=O)C(F)(F)F.N#C[C@@H]1CCCN1
Complexity:
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Smiles: NC1CCN(CC1(C)C)Cc1ccccc1
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Smiles:
NC1CCN(CC1(C)C)Cc1ccccc1
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Smiles: CCOC(=O)Cc1ccc2c(c1)nccn2
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Smiles:
CCOC(=O)Cc1ccc2c(c1)nccn2
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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