AI11869
1185291-72-8 | 3,4,5,6-Tetrahydro-2h-[1,2']bipyridinyl-4,3'-dicarboxylic acid 3'-ethyl ester 4-methyl ester
Manufacturer: A2B Chem
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CatalogNumber
AI11869
ChemicalName
3,4,5,6-Tetrahydro-2h-[1,2']bipyridinyl-4,3'-dicarboxylic acid 3'-ethyl ester 4-methyl ester
CasNumber
1185291-72-8
MolecularFormula
C15H20N2O4
MolecularWeight
292.3303
MdlNumber
MFCD07368259
Smiles
CCOC(=O)c1cccnc1N1CCC(CC1)C(=O)OC
Complexity
367
Covalently-bondedUnitCount
1
HeavyAtomCount
21
HydrogenBondAcceptorCount
6
RotatableBondCount
6
Xlogp3
1.9
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CatalogNumber: AI11869
ChemicalName: 3,4,5,6-Tetrahydro-2h-[1,2']bipyridinyl-4,3'-dicarboxylic acid 3'-ethyl ester 4-methyl ester
CasNumber: 1185291-72-8
MolecularFormula: C15H20N2O4
MolecularWeight: 292.3303
MdlNumber: MFCD07368259
Smiles: CCOC(=O)c1cccnc1N1CCC(CC1)C(=O)OC
Complexity: 367
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 6
RotatableBondCount: 6
Xlogp3: 1.9
CatalogNumber:
AI11869
ChemicalName:
3,4,5,6-Tetrahydro-2h-[1,2']bipyridinyl-4,3'-dicarboxylic acid 3'-ethyl ester 4-methyl ester
CasNumber:
1185291-72-8
MolecularFormula:
C15H20N2O4
MolecularWeight:
292.3303
MdlNumber:
MFCD07368259
Smiles:
CCOC(=O)c1cccnc1N1CCC(CC1)C(=O)OC
Complexity:
367
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
6
RotatableBondCount:
6
Xlogp3:
1.9
CatalogNumber: __
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Smiles: NCc1sc(nc1C)C.Cl.Cl
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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Xlogp3: __
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Smiles:
NCc1sc(nc1C)C.Cl.Cl
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
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Smiles: CSC(=N)c1cccnc1.I
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__
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Smiles:
CSC(=N)c1cccnc1.I
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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Smiles: OC(=O)C1CCN(CC1)C1CCNCC1.Cl.Cl
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)C1CCN(CC1)C1CCNCC1.Cl.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__