AD37906
113451-59-5 | (1S,4S)-2-Boc-2,5-diazabicyclo[2.2.1]heptane
Manufacturer: A2B Chem
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CatalogNumber
AD37906
ChemicalName
(1S,4S)-2-Boc-2,5-diazabicyclo[2.2.1]heptane
CasNumber
113451-59-5
MolecularFormula
C10H18N2O2
MolecularWeight
198.2621
MdlNumber
MFCD01569250
Smiles
O=C(N1C[C@@H]2C[C@H]1CN2)OC(C)(C)C
Complexity
247
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
2
HeavyAtomCount
14
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
0.7
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CatalogNumber: AD37906
ChemicalName: (1S,4S)-2-Boc-2,5-diazabicyclo[2.2.1]heptane
CasNumber: 113451-59-5
MolecularFormula: C10H18N2O2
MolecularWeight: 198.2621
MdlNumber: MFCD01569250
Smiles: O=C(N1C[C@@H]2C[C@H]1CN2)OC(C)(C)C
Complexity: 247
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 2
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 0.7
CatalogNumber:
AD37906
ChemicalName:
(1S,4S)-2-Boc-2,5-diazabicyclo[2.2.1]heptane
CasNumber:
113451-59-5
MolecularFormula:
C10H18N2O2
MolecularWeight:
198.2621
MdlNumber:
MFCD01569250
Smiles:
O=C(N1C[C@@H]2C[C@H]1CN2)OC(C)(C)C
Complexity:
247
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
2
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
0.7
CatalogNumber: __
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MolecularFormula: __
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Smiles: OC[C@H]([C@H](Cc1ncc(nc1)[C@H]([C@@H]([C@@H](CO)O)O)O)O)O
Complexity: __
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Smiles:
OC[C@H]([C@H](Cc1ncc(nc1)[C@H]([C@@H]([C@@H](CO)O)O)O)O)O
Complexity:
__
Covalently-bondedUnitCount:
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Xlogp3:
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Smiles: CCn1c(=S)[nH]nc1c1ccc(cc1)C(C)(C)C
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Smiles:
CCn1c(=S)[nH]nc1c1ccc(cc1)C(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: __
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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ChemicalName:
__
CasNumber:
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MolecularFormula:
__
MolecularWeight:
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MdlNumber:
__
Smiles:
__
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__