AI32302
1357353-12-8 | 7-Benzyl-3-oxa-7,9-diazabicyclo[3.3.1]nonane
Manufacturer: A2B Chem
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CatalogNumber
AI32302
ChemicalName
7-Benzyl-3-oxa-7,9-diazabicyclo[3.3.1]nonane
CasNumber
1357353-12-8
MolecularFormula
C13H18N2O
MolecularWeight
218.2948
MdlNumber
MFCD22209406
Smiles
O1CC2NC(C1)CN(C2)Cc1ccccc1
Complexity
216
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
UndefinedAtomStereocenterCount
2
Xlogp3
0.9
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CatalogNumber: AI32302
ChemicalName: 7-Benzyl-3-oxa-7,9-diazabicyclo[3.3.1]nonane
CasNumber: 1357353-12-8
MolecularFormula: C13H18N2O
MolecularWeight: 218.2948
MdlNumber: MFCD22209406
Smiles: O1CC2NC(C1)CN(C2)Cc1ccccc1
Complexity: 216
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
UndefinedAtomStereocenterCount: 2
Xlogp3: 0.9
CatalogNumber:
AI32302
ChemicalName:
7-Benzyl-3-oxa-7,9-diazabicyclo[3.3.1]nonane
CasNumber:
1357353-12-8
MolecularFormula:
C13H18N2O
MolecularWeight:
218.2948
MdlNumber:
MFCD22209406
Smiles:
O1CC2NC(C1)CN(C2)Cc1ccccc1
Complexity:
216
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
2
Xlogp3:
0.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OCC1COCCC21CN(C2)C(=O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OCC1COCCC21CN(C2)C(=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: FC1CC2NCC(C1)C2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
FC1CC2NCC(C1)C2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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UndefinedAtomStereocenterCount:
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Xlogp3:
__
CatalogNumber: AI32305
ChemicalName: 2-Ethynyl-pyridin-4-ylamine hydrochloride
CasNumber: 1357353-33-3
MolecularFormula: C7H7ClN2
MolecularWeight: 154.5969
MdlNumber: MFCD23378458
Smiles: Nc1cc(ncc1)C#C.Cl
Complexity: 133
Covalently-bondedUnitCount: 2
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 1
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
AI32305
ChemicalName:
2-Ethynyl-pyridin-4-ylamine hydrochloride
CasNumber:
1357353-33-3
MolecularFormula:
C7H7ClN2
MolecularWeight:
154.5969
MdlNumber:
MFCD23378458
Smiles:
Nc1cc(ncc1)C#C.Cl
Complexity:
133
Covalently-bondedUnitCount:
2
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
1
UndefinedAtomStereocenterCount:
__
Xlogp3:
__