AI10095
1160247-52-8 | tert-Butyl 7-bromo-3-oxo-2,3-dihydrospiro[indene-1,4'-piperidine]-1'-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AI10095
ChemicalName
tert-Butyl 7-bromo-3-oxo-2,3-dihydrospiro[indene-1,4'-piperidine]-1'-carboxylate
CasNumber
1160247-52-8
MolecularFormula
C18H22BrNO3
MolecularWeight
380.2762
MdlNumber
MFCD12198608
Smiles
O=C(N1CCC2(CC1)CC(=O)c1c2c(Br)ccc1)OC(C)(C)C
Complexity
491
Covalently-bondedUnitCount
1
HeavyAtomCount
23
HydrogenBondAcceptorCount
3
RotatableBondCount
2
Xlogp3
3.5
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CatalogNumber: AI10095
ChemicalName: tert-Butyl 7-bromo-3-oxo-2,3-dihydrospiro[indene-1,4'-piperidine]-1'-carboxylate
CasNumber: 1160247-52-8
MolecularFormula: C18H22BrNO3
MolecularWeight: 380.2762
MdlNumber: MFCD12198608
Smiles: O=C(N1CCC2(CC1)CC(=O)c1c2c(Br)ccc1)OC(C)(C)C
Complexity: 491
Covalently-bondedUnitCount: 1
HeavyAtomCount: 23
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 3.5
CatalogNumber:
AI10095
ChemicalName:
tert-Butyl 7-bromo-3-oxo-2,3-dihydrospiro[indene-1,4'-piperidine]-1'-carboxylate
CasNumber:
1160247-52-8
MolecularFormula:
C18H22BrNO3
MolecularWeight:
380.2762
MdlNumber:
MFCD12198608
Smiles:
O=C(N1CCC2(CC1)CC(=O)c1c2c(Br)ccc1)OC(C)(C)C
Complexity:
491
Covalently-bondedUnitCount:
1
HeavyAtomCount:
23
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
3.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Cc1ccc2c(c1)C(N)CC12CCN(CC1)C(=O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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MolecularFormula:
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MolecularWeight:
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Smiles:
Cc1ccc2c(c1)C(N)CC12CCN(CC1)C(=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(N1CCC2(CC1)CC(c1c2cc(F)cc1)CC(=O)O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
O=C(N1CCC2(CC1)CC(c1c2cc(F)cc1)CC(=O)O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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CatalogNumber: AI10098
ChemicalName: 2-(1'-(tert-Butoxycarbonyl)-5,6-dimethoxy-2,3-dihydrospiro[indene-1,4'-piperidin]-3-yl)acetic acid
CasNumber: 1160247-56-2
MolecularFormula: C22H31NO6
MolecularWeight: 405.4846
MdlNumber: MFCD12198612
Smiles: COc1cc2c(cc1OC)C(CC12CCN(CC1)C(=O)OC(C)(C)C)CC(=O)O
Complexity: 607
Covalently-bondedUnitCount: 1
HeavyAtomCount: 29
HydrogenBondAcceptorCount: 6
RotatableBondCount: 6
Xlogp3: 3.2
CatalogNumber:
AI10098
ChemicalName:
2-(1'-(tert-Butoxycarbonyl)-5,6-dimethoxy-2,3-dihydrospiro[indene-1,4'-piperidin]-3-yl)acetic acid
CasNumber:
1160247-56-2
MolecularFormula:
C22H31NO6
MolecularWeight:
405.4846
MdlNumber:
MFCD12198612
Smiles:
COc1cc2c(cc1OC)C(CC12CCN(CC1)C(=O)OC(C)(C)C)CC(=O)O
Complexity:
607
Covalently-bondedUnitCount:
1
HeavyAtomCount:
29
HydrogenBondAcceptorCount:
6
RotatableBondCount:
6
Xlogp3:
3.2