AI16347
1251014-54-6 | 1-tert-Butyl 6-methyl 1,2,3,4-tetrahydro-1,5-naphthyridine-1,6-dicarboxylate
Manufacturer: A2B Chem
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CatalogNumber
AI16347
ChemicalName
1-tert-Butyl 6-methyl 1,2,3,4-tetrahydro-1,5-naphthyridine-1,6-dicarboxylate
CasNumber
1251014-54-6
MolecularFormula
C15H20N2O4
MolecularWeight
292.3303
MdlNumber
MFCD15530219
Smiles
COC(=O)c1ccc2c(n1)CCCN2C(=O)OC(C)(C)C
Complexity
405
Covalently-bondedUnitCount
1
HeavyAtomCount
21
HydrogenBondAcceptorCount
5
RotatableBondCount
4
Xlogp3
2.2
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CatalogNumber: AI16347
ChemicalName: 1-tert-Butyl 6-methyl 1,2,3,4-tetrahydro-1,5-naphthyridine-1,6-dicarboxylate
CasNumber: 1251014-54-6
MolecularFormula: C15H20N2O4
MolecularWeight: 292.3303
MdlNumber: MFCD15530219
Smiles: COC(=O)c1ccc2c(n1)CCCN2C(=O)OC(C)(C)C
Complexity: 405
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 5
RotatableBondCount: 4
Xlogp3: 2.2
CatalogNumber:
AI16347
ChemicalName:
1-tert-Butyl 6-methyl 1,2,3,4-tetrahydro-1,5-naphthyridine-1,6-dicarboxylate
CasNumber:
1251014-54-6
MolecularFormula:
C15H20N2O4
MolecularWeight:
292.3303
MdlNumber:
MFCD15530219
Smiles:
COC(=O)c1ccc2c(n1)CCCN2C(=O)OC(C)(C)C
Complexity:
405
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
5
RotatableBondCount:
4
Xlogp3:
2.2
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Smiles: OCc1noc2c1CN(CC2)C(=O)OC(C)(C)C
Complexity: __
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Smiles:
OCc1noc2c1CN(CC2)C(=O)OC(C)(C)C
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HydrogenBondAcceptorCount:
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Smiles: OCc1n[nH]c2c1CCN(C2)C(=O)OC(C)(C)C
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Smiles:
OCc1n[nH]c2c1CCN(C2)C(=O)OC(C)(C)C
Complexity:
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Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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__
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Smiles: OCc1ncn2c1CN(CC2)C(=O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OCc1ncn2c1CN(CC2)C(=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__