AA72335
144675-97-8 | Pixantrone dimaleate
Manufacturer: A2B Chem
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CatalogNumber
AA72335
ChemicalName
Pixantrone dimaleate
CasNumber
144675-97-8
MolecularFormula
C25H27N5O10
MolecularWeight
557.5094
MdlNumber
MFCD00920108
Smiles
OC(=O)C=CC(=O)O.OC(=O)C=CC(=O)O.NCCNc1ccc(c2c1C(=O)c1cnccc1C2=O)NCCN
Complexity
591
Covalently-bondedUnitCount
3
DefinedBondStereocenterCount
2
HeavyAtomCount
40
HydrogenBondAcceptorCount
15
HydrogenBondDonorCount
8
RotatableBondCount
10
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CatalogNumber: AA72335
ChemicalName: Pixantrone dimaleate
CasNumber: 144675-97-8
MolecularFormula: C25H27N5O10
MolecularWeight: 557.5094
MdlNumber: MFCD00920108
Smiles: OC(=O)C=CC(=O)O.OC(=O)C=CC(=O)O.NCCNc1ccc(c2c1C(=O)c1cnccc1C2=O)NCCN
Complexity: 591
Covalently-bondedUnitCount: 3
DefinedBondStereocenterCount: 2
HeavyAtomCount: 40
HydrogenBondAcceptorCount: 15
HydrogenBondDonorCount: 8
RotatableBondCount: 10
CatalogNumber:
AA72335
ChemicalName:
Pixantrone dimaleate
CasNumber:
144675-97-8
MolecularFormula:
C25H27N5O10
MolecularWeight:
557.5094
MdlNumber:
MFCD00920108
Smiles:
OC(=O)C=CC(=O)O.OC(=O)C=CC(=O)O.NCCNc1ccc(c2c1C(=O)c1cnccc1C2=O)NCCN
Complexity:
591
Covalently-bondedUnitCount:
3
DefinedBondStereocenterCount:
2
HeavyAtomCount:
40
HydrogenBondAcceptorCount:
15
HydrogenBondDonorCount:
8
RotatableBondCount:
10
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Smiles: NC(=O)c1cccn2c1ncc2
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Smiles:
NC(=O)c1cccn2c1ncc2
Complexity:
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DefinedBondStereocenterCount:
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HeavyAtomCount:
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HydrogenBondDonorCount:
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MolecularFormula: __
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Smiles: [O-][N+](=O)c1ccc(cc1)OCCOc1ccc(cc1)[N+](=O)[O-]
Complexity: __
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DefinedBondStereocenterCount: __
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RotatableBondCount: __
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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:
[O-][N+](=O)c1ccc(cc1)OCCOc1ccc(cc1)[N+](=O)[O-]
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedBondStereocenterCount:
__
HeavyAtomCount:
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HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [O-][N+](=O)c1ccc(cc1)OCCCCOc1ccc(cc1)[N+](=O)[O-]
Complexity: __
Covalently-bondedUnitCount: __
DefinedBondStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[O-][N+](=O)c1ccc(cc1)OCCCCOc1ccc(cc1)[N+](=O)[O-]
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedBondStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__