AD69679
1508-75-4 | N-ethyl-3-hydroxy-2-phenyl-N-(pyridin-4-ylmethyl)propanamide
Manufacturer: A2B Chem
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CatalogNumber
AD69679
ChemicalName
N-ethyl-3-hydroxy-2-phenyl-N-(pyridin-4-ylmethyl)propanamide
CasNumber
1508-75-4
MolecularFormula
C17H20N2O2
MolecularWeight
284.3529
MdlNumber
MFCD00058580
Smiles
CCN(C(=O)C(c1ccccc1)CO)Cc1ccncc1
NscNumber
757372
Complexity
310
Covalently-bondedUnitCount
1
HeavyAtomCount
21
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
6
UndefinedAtomStereocenterCount
1
Xlogp3
1.5
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CatalogNumber: AD69679
ChemicalName: N-ethyl-3-hydroxy-2-phenyl-N-(pyridin-4-ylmethyl)propanamide
CasNumber: 1508-75-4
MolecularFormula: C17H20N2O2
MolecularWeight: 284.3529
MdlNumber: MFCD00058580
Smiles: CCN(C(=O)C(c1ccccc1)CO)Cc1ccncc1
NscNumber: 757372
Complexity: 310
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 6
UndefinedAtomStereocenterCount: 1
Xlogp3: 1.5
CatalogNumber:
AD69679
ChemicalName:
N-ethyl-3-hydroxy-2-phenyl-N-(pyridin-4-ylmethyl)propanamide
CasNumber:
1508-75-4
MolecularFormula:
C17H20N2O2
MolecularWeight:
284.3529
MdlNumber:
MFCD00058580
Smiles:
CCN(C(=O)C(c1ccccc1)CO)Cc1ccncc1
NscNumber:
757372
Complexity:
310
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
6
UndefinedAtomStereocenterCount:
1
Xlogp3:
1.5
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Smiles: OP(=O)(O)O.CN(CCCN1c2ccccc2Sc2c1cccc2)C
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Smiles:
OP(=O)(O)O.CN(CCCN1c2ccccc2Sc2c1cccc2)C
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Complexity:
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HeavyAtomCount:
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Smiles: Cc1ccc(c(c1)OC(=O)c1ccccc1)C
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Smiles:
Cc1ccc(c(c1)OC(=O)c1ccccc1)C
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HeavyAtomCount:
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RotatableBondCount:
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__
Xlogp3:
__
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Smiles: ICC(=O)NCCC(=O)ON1C(=O)CCC1=O
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Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
ICC(=O)NCCC(=O)ON1C(=O)CCC1=O
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__