AB85974
895525-73-2 | tert-Butyl 6-bromo-4h-spiro[benzo[d][1,3]dioxine-2,4'-piperidine]-1'-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AB85974
ChemicalName
tert-Butyl 6-bromo-4h-spiro[benzo[d][1,3]dioxine-2,4'-piperidine]-1'-carboxylate
CasNumber
895525-73-2
MolecularFormula
C17H22BrNO4
MolecularWeight
384.2649
MdlNumber
MFCD13195393
Smiles
Brc1ccc2c(c1)COC1(O2)CCN(CC1)C(=O)OC(C)(C)C
Complexity
442
Covalently-bondedUnitCount
1
HeavyAtomCount
23
HydrogenBondAcceptorCount
4
RotatableBondCount
2
Xlogp3
3.4
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CatalogNumber: AB85974
ChemicalName: tert-Butyl 6-bromo-4h-spiro[benzo[d][1,3]dioxine-2,4'-piperidine]-1'-carboxylate
CasNumber: 895525-73-2
MolecularFormula: C17H22BrNO4
MolecularWeight: 384.2649
MdlNumber: MFCD13195393
Smiles: Brc1ccc2c(c1)COC1(O2)CCN(CC1)C(=O)OC(C)(C)C
Complexity: 442
Covalently-bondedUnitCount: 1
HeavyAtomCount: 23
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: 3.4
CatalogNumber:
AB85974
ChemicalName:
tert-Butyl 6-bromo-4h-spiro[benzo[d][1,3]dioxine-2,4'-piperidine]-1'-carboxylate
CasNumber:
895525-73-2
MolecularFormula:
C17H22BrNO4
MolecularWeight:
384.2649
MdlNumber:
MFCD13195393
Smiles:
Brc1ccc2c(c1)COC1(O2)CCN(CC1)C(=O)OC(C)(C)C
Complexity:
442
Covalently-bondedUnitCount:
1
HeavyAtomCount:
23
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
3.4
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Smiles: N#Cc1ccc(cc1)c1ncnc2c1cnn2c1ccccc1
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N#Cc1ccc(cc1)c1ncnc2c1cnn2c1ccccc1
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Smiles: OC(=O)c1cnc(c(c1)C(=O)O)N
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OC(=O)c1cnc(c(c1)C(=O)O)N
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Smiles: COCCCOc1cc(OC)cc(c1)C=O
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Smiles:
COCCCOc1cc(OC)cc(c1)C=O
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Xlogp3:
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