AI16244
1251000-69-7 | 2-Hydroxymethyl-1,4,6,7-tetrahydro-imidazo[4,5-c]pyridine-5-carboxylic acid tert-butyl ester
Manufacturer: A2B Chem
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CatalogNumber
AI16244
ChemicalName
2-Hydroxymethyl-1,4,6,7-tetrahydro-imidazo[4,5-c]pyridine-5-carboxylic acid tert-butyl ester
CasNumber
1251000-69-7
MolecularFormula
C12H19N3O3
MolecularWeight
253.2976
MdlNumber
MFCD17017213
Smiles
OCc1nc2c([nH]1)CN(CC2)C(=O)OC(C)(C)C
Complexity
316
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
3
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CatalogNumber: AI16244
ChemicalName: 2-Hydroxymethyl-1,4,6,7-tetrahydro-imidazo[4,5-c]pyridine-5-carboxylic acid tert-butyl ester
CasNumber: 1251000-69-7
MolecularFormula: C12H19N3O3
MolecularWeight: 253.2976
MdlNumber: MFCD17017213
Smiles: OCc1nc2c([nH]1)CN(CC2)C(=O)OC(C)(C)C
Complexity: 316
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 3
CatalogNumber:
AI16244
ChemicalName:
2-Hydroxymethyl-1,4,6,7-tetrahydro-imidazo[4,5-c]pyridine-5-carboxylic acid tert-butyl ester
CasNumber:
1251000-69-7
MolecularFormula:
C12H19N3O3
MolecularWeight:
253.2976
MdlNumber:
MFCD17017213
Smiles:
OCc1nc2c([nH]1)CN(CC2)C(=O)OC(C)(C)C
Complexity:
316
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
3
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Smiles: O=C(N1CCN(CC2(C1)CCCCN2)C(=O)OC(C)(C)C)OCc1ccccc1
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Smiles:
O=C(N1CCN(CC2(C1)CCCCN2)C(=O)OC(C)(C)C)OCc1ccccc1
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Smiles: O=C(N1C[C@@H]2[C@H](C1)[C@H](CCC2)C(=O)O)OC(C)(C)C
Complexity: __
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CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(N1C[C@@H]2[C@H](C1)[C@H](CCC2)C(=O)O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__