AI48856
3599-32-4 | Cardiogreen
Manufacturer: A2B Chem
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CatalogNumber
AI48856
ChemicalName
Cardiogreen
CasNumber
3599-32-4
MolecularFormula
C43H47N2NaO6S2
MolecularWeight
774.9628500000003
MdlNumber
MFCD00013078
Smiles
[O-]S(=O)(=O)CCCCN1c2ccc3c(c2C(/C/1=C\C=C\C=C\C=C\C1=[N+](CCCCS(=O)(=O)[O-])c2c(C1(C)C)c1ccccc1cc2)(C)C)cccc3.[Na+]
Complexity
1520
Covalently-bondedUnitCount
2
DefinedBondStereocenterCount
4
HeavyAtomCount
54
HydrogenBondAcceptorCount
7
RotatableBondCount
12
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CatalogNumber: AI48856
ChemicalName: Cardiogreen
CasNumber: 3599-32-4
MolecularFormula: C43H47N2NaO6S2
MolecularWeight: 774.9628500000003
MdlNumber: MFCD00013078
Smiles: [O-]S(=O)(=O)CCCCN1c2ccc3c(c2C(/C/1=C\C=C\C=C\C=C\C1=[N+](CCCCS(=O)(=O)[O-])c2c(C1(C)C)c1ccccc1cc2)(C)C)cccc3.[Na+]
Complexity: 1520
Covalently-bondedUnitCount: 2
DefinedBondStereocenterCount: 4
HeavyAtomCount: 54
HydrogenBondAcceptorCount: 7
RotatableBondCount: 12
CatalogNumber:
AI48856
ChemicalName:
Cardiogreen
CasNumber:
3599-32-4
MolecularFormula:
C43H47N2NaO6S2
MolecularWeight:
774.9628500000003
MdlNumber:
MFCD00013078
Smiles:
[O-]S(=O)(=O)CCCCN1c2ccc3c(c2C(/C/1=C\C=C\C=C\C=C\C1=[N+](CCCCS(=O)(=O)[O-])c2c(C1(C)C)c1ccccc1cc2)(C)C)cccc3.[Na+]
Complexity:
1520
Covalently-bondedUnitCount:
2
DefinedBondStereocenterCount:
4
HeavyAtomCount:
54
HydrogenBondAcceptorCount:
7
RotatableBondCount:
12
CatalogNumber: AI48857
ChemicalName: Propionamidine, HCl
CasNumber: 3599-89-1
MolecularFormula: C3H9ClN2
MolecularWeight: 108.57
MdlNumber: MFCD00233938
Smiles: CCC(=N)N.Cl
Complexity: 40.2
Covalently-bondedUnitCount: 2
DefinedBondStereocenterCount: __
HeavyAtomCount: 6
HydrogenBondAcceptorCount: 1
RotatableBondCount: 1
CatalogNumber:
AI48857
ChemicalName:
Propionamidine, HCl
CasNumber:
3599-89-1
MolecularFormula:
C3H9ClN2
MolecularWeight:
108.57
MdlNumber:
MFCD00233938
Smiles:
CCC(=N)N.Cl
Complexity:
40.2
Covalently-bondedUnitCount:
2
DefinedBondStereocenterCount:
__
HeavyAtomCount:
6
HydrogenBondAcceptorCount:
1
RotatableBondCount:
1
CatalogNumber: AI48858
ChemicalName: 3-Chloro-1-(4-methoxyphenyl)propan-1-one
CasNumber: 35999-20-3
MolecularFormula: C10H11ClO2
MolecularWeight: 198.6461
MdlNumber: MFCD00236602
Smiles: ClCCC(=O)c1ccc(cc1)OC
Complexity: __
Covalently-bondedUnitCount: __
DefinedBondStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
CatalogNumber:
AI48858
ChemicalName:
3-Chloro-1-(4-methoxyphenyl)propan-1-one
CasNumber:
35999-20-3
MolecularFormula:
C10H11ClO2
MolecularWeight:
198.6461
MdlNumber:
MFCD00236602
Smiles:
ClCCC(=O)c1ccc(cc1)OC
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedBondStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: ClCCC(=O)c1ccccc1O
Complexity: __
Covalently-bondedUnitCount: __
DefinedBondStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
ClCCC(=O)c1ccccc1O
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedBondStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__