AG73175
630117-19-0 | N-((4-(2-Cyanophenyl)piperazin-1-yl)methyl)-3-methylbenzamide maleate
Manufacturer: A2B Chem
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CatalogNumber
AG73175
ChemicalName
N-((4-(2-Cyanophenyl)piperazin-1-yl)methyl)-3-methylbenzamide maleate
CasNumber
630117-19-0
MolecularFormula
C24H26N4O5
MolecularWeight
450.487
MdlNumber
MFCD01321067
Smiles
OC(=O)C=CC(=O)O.N#Cc1ccccc1N1CCN(CC1)CNC(=O)c1cccc(c1)C
Complexity
610
Covalently-bondedUnitCount
2
DefinedBondStereocenterCount
1
HeavyAtomCount
33
HydrogenBondAcceptorCount
8
HydrogenBondDonorCount
3
RotatableBondCount
6
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CatalogNumber: AG73175
ChemicalName: N-((4-(2-Cyanophenyl)piperazin-1-yl)methyl)-3-methylbenzamide maleate
CasNumber: 630117-19-0
MolecularFormula: C24H26N4O5
MolecularWeight: 450.487
MdlNumber: MFCD01321067
Smiles: OC(=O)C=CC(=O)O.N#Cc1ccccc1N1CCN(CC1)CNC(=O)c1cccc(c1)C
Complexity: 610
Covalently-bondedUnitCount: 2
DefinedBondStereocenterCount: 1
HeavyAtomCount: 33
HydrogenBondAcceptorCount: 8
HydrogenBondDonorCount: 3
RotatableBondCount: 6
CatalogNumber:
AG73175
ChemicalName:
N-((4-(2-Cyanophenyl)piperazin-1-yl)methyl)-3-methylbenzamide maleate
CasNumber:
630117-19-0
MolecularFormula:
C24H26N4O5
MolecularWeight:
450.487
MdlNumber:
MFCD01321067
Smiles:
OC(=O)C=CC(=O)O.N#Cc1ccccc1N1CCN(CC1)CNC(=O)c1cccc(c1)C
Complexity:
610
Covalently-bondedUnitCount:
2
DefinedBondStereocenterCount:
1
HeavyAtomCount:
33
HydrogenBondAcceptorCount:
8
HydrogenBondDonorCount:
3
RotatableBondCount:
6
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Smiles: COC1=CC(=C(C(=C1)OC)C(=O)C=CC2=CC=C(C=C2)O)O
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Smiles:
COC1=CC(=C(C(=C1)OC)C(=O)C=CC2=CC=C(C=C2)O)O
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Smiles: COc1cc2c(CCNC(=O)C)c[nH]c2cc1Cl
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COc1cc2c(CCNC(=O)C)c[nH]c2cc1Cl
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Smiles: OC(=O)CCC(=O)C(=O)[O-].[K+]
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
OC(=O)CCC(=O)C(=O)[O-].[K+]
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedBondStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
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