AH84298
937039-45-7 | Pimelic Diphenylamide 106
Manufacturer: A2B Chem
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CatalogNumber
AH84298
ChemicalName
Pimelic Diphenylamide 106
CasNumber
937039-45-7
MolecularFormula
C20H25N3O2
MolecularWeight
339.4314
MdlNumber
MFCD17010287
Smiles
O=C(Nc1ccc(cc1)C)CCCCCC(=O)Nc1ccccc1N
Complexity
419
Covalently-bondedUnitCount
1
HeavyAtomCount
25
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
3
RotatableBondCount
8
Xlogp3
2.8
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CatalogNumber: AH84298
ChemicalName: Pimelic Diphenylamide 106
CasNumber: 937039-45-7
MolecularFormula: C20H25N3O2
MolecularWeight: 339.4314
MdlNumber: MFCD17010287
Smiles: O=C(Nc1ccc(cc1)C)CCCCCC(=O)Nc1ccccc1N
Complexity: 419
Covalently-bondedUnitCount: 1
HeavyAtomCount: 25
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 3
RotatableBondCount: 8
Xlogp3: 2.8
CatalogNumber:
AH84298
ChemicalName:
Pimelic Diphenylamide 106
CasNumber:
937039-45-7
MolecularFormula:
C20H25N3O2
MolecularWeight:
339.4314
MdlNumber:
MFCD17010287
Smiles:
O=C(Nc1ccc(cc1)C)CCCCCC(=O)Nc1ccccc1N
Complexity:
419
Covalently-bondedUnitCount:
1
HeavyAtomCount:
25
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
3
RotatableBondCount:
8
Xlogp3:
2.8
CatalogNumber: __
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Smiles: CCCCCCCC(=O)OC[C@@H](OC(=O)CCCCCCC)COP(=O)(O[C@@H]1[C@H](O)[C@H](O)[C@H]([C@@H]([C@H]1O)O)O)[O-].[Na+]
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
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Smiles:
CCCCCCCC(=O)OC[C@@H](OC(=O)CCCCCCC)COP(=O)(O[C@@H]1[C@H](O)[C@H](O)[C@H]([C@@H]([C@H]1O)O)O)[O-].[Na+]
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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Smiles: C#CCCCC(=O)Nc1ccc(cc1)C(=O)c1ccc(cc1)NC(=O)CCCCCCC(=O)NO
Complexity: __
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Smiles:
C#CCCCC(=O)Nc1ccc(cc1)C(=O)c1ccc(cc1)NC(=O)CCCCCCC(=O)NO
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
__
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Smiles: CCCCc1nc2c(n1CCN(CC)CC)ccc(c2)/C=C/C(=O)NO
Complexity: __
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MolecularFormula:
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Smiles:
CCCCc1nc2c(n1CCN(CC)CC)ccc(c2)/C=C/C(=O)NO
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__