AX11910
1956364-79-6 | Methyl 3-(1-(5-ethylpyrimidin-2-yl)piperidin-4-yl)benzoate
Manufacturer: A2B Chem
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CatalogNumber
AX11910
ChemicalName
Methyl 3-(1-(5-ethylpyrimidin-2-yl)piperidin-4-yl)benzoate
CasNumber
1956364-79-6
MolecularFormula
C19H23N3O2
MolecularWeight
325.4048
MdlNumber
MFCD28991811
Smiles
COC(=O)c1cccc(c1)C1CCN(CC1)c1ncc(cn1)CC
Complexity
401
Covalently-bondedUnitCount
1
HeavyAtomCount
24
HydrogenBondAcceptorCount
5
RotatableBondCount
5
Xlogp3
3.5
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CatalogNumber: AX11910
ChemicalName: Methyl 3-(1-(5-ethylpyrimidin-2-yl)piperidin-4-yl)benzoate
CasNumber: 1956364-79-6
MolecularFormula: C19H23N3O2
MolecularWeight: 325.4048
MdlNumber: MFCD28991811
Smiles: COC(=O)c1cccc(c1)C1CCN(CC1)c1ncc(cn1)CC
Complexity: 401
Covalently-bondedUnitCount: 1
HeavyAtomCount: 24
HydrogenBondAcceptorCount: 5
RotatableBondCount: 5
Xlogp3: 3.5
CatalogNumber:
AX11910
ChemicalName:
Methyl 3-(1-(5-ethylpyrimidin-2-yl)piperidin-4-yl)benzoate
CasNumber:
1956364-79-6
MolecularFormula:
C19H23N3O2
MolecularWeight:
325.4048
MdlNumber:
MFCD28991811
Smiles:
COC(=O)c1cccc(c1)C1CCN(CC1)c1ncc(cn1)CC
Complexity:
401
Covalently-bondedUnitCount:
1
HeavyAtomCount:
24
HydrogenBondAcceptorCount:
5
RotatableBondCount:
5
Xlogp3:
3.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: NCC1(N)CCN(C1)C(=O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
NCC1(N)CCN(C1)C(=O)OC(C)(C)C
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: CC(=O)c1ccc(nc1)Oc1ccc(cc1C(C)(C)C)C(C)(C)C
Complexity: 432
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 5.7
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MolecularFormula:
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MolecularWeight:
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Smiles:
CC(=O)c1ccc(nc1)Oc1ccc(cc1C(C)(C)C)C(C)(C)C
Complexity:
432
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
5.7
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Smiles: ClCc1nccc(c1)OCC(C(C(F)(F)F)(F)F)(F)F
Complexity: __
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HeavyAtomCount: __
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MolecularFormula:
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MolecularWeight:
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Smiles:
ClCc1nccc(c1)OCC(C(C(F)(F)F)(F)F)(F)F
Complexity:
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Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Xlogp3:
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