AA29007
1246551-25-6 | 7-Boc-3-oxohexahydroimidazo[1,5-a]pyrazine
Manufacturer: A2B Chem
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CatalogNumber
AA29007
ChemicalName
7-Boc-3-oxohexahydroimidazo[1,5-a]pyrazine
CasNumber
1246551-25-6
MolecularFormula
C11H19N3O3
MolecularWeight
241.2869
MdlNumber
MFCD18711442
Smiles
O=C(N1CCN2C(C1)CNC2=O)OC(C)(C)C
Complexity
337
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
UndefinedAtomStereocenterCount
1
Xlogp3
0.1
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CatalogNumber: AA29007
ChemicalName: 7-Boc-3-oxohexahydroimidazo[1,5-a]pyrazine
CasNumber: 1246551-25-6
MolecularFormula: C11H19N3O3
MolecularWeight: 241.2869
MdlNumber: MFCD18711442
Smiles: O=C(N1CCN2C(C1)CNC2=O)OC(C)(C)C
Complexity: 337
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
UndefinedAtomStereocenterCount: 1
Xlogp3: 0.1
CatalogNumber:
AA29007
ChemicalName:
7-Boc-3-oxohexahydroimidazo[1,5-a]pyrazine
CasNumber:
1246551-25-6
MolecularFormula:
C11H19N3O3
MolecularWeight:
241.2869
MdlNumber:
MFCD18711442
Smiles:
O=C(N1CCN2C(C1)CNC2=O)OC(C)(C)C
Complexity:
337
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
1
Xlogp3:
0.1
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Smiles: CN1CCNCC1C(=O)O.Cl.Cl
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Smiles:
CN1CCNCC1C(=O)O.Cl.Cl
Complexity:
__
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__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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UndefinedAtomStereocenterCount:
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Smiles: Clc1cnc2c(c1)ncc(c2)Br
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Smiles:
Clc1cnc2c(c1)ncc(c2)Br
Complexity:
__
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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UndefinedAtomStereocenterCount:
__
Xlogp3:
__
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Smiles: Brc1ccc2c(c1)ncc(c2)C(F)(F)F
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Brc1ccc2c(c1)ncc(c2)C(F)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__