AG21404
4403-78-5 | N,N'-Bis(toluenesulfonyl)-1,2-ethylenediamine
Manufacturer: A2B Chem
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CatalogNumber
AG21404
ChemicalName
N,N'-Bis(toluenesulfonyl)-1,2-ethylenediamine
CasNumber
4403-78-5
MolecularFormula
C16H20N2O4S2
MolecularWeight
368.471
MdlNumber
MFCD00025993
Smiles
Cc1ccc(cc1)S(=O)(=O)NCCNS(=O)(=O)c1ccc(cc1)C
NscNumber
25018
Complexity
523
Covalently-bondedUnitCount
1
HeavyAtomCount
24
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
2
RotatableBondCount
7
Xlogp3
2.3
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CatalogNumber: AG21404
ChemicalName: N,N'-Bis(toluenesulfonyl)-1,2-ethylenediamine
CasNumber: 4403-78-5
MolecularFormula: C16H20N2O4S2
MolecularWeight: 368.471
MdlNumber: MFCD00025993
Smiles: Cc1ccc(cc1)S(=O)(=O)NCCNS(=O)(=O)c1ccc(cc1)C
NscNumber: 25018
Complexity: 523
Covalently-bondedUnitCount: 1
HeavyAtomCount: 24
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 2
RotatableBondCount: 7
Xlogp3: 2.3
CatalogNumber:
AG21404
ChemicalName:
N,N'-Bis(toluenesulfonyl)-1,2-ethylenediamine
CasNumber:
4403-78-5
MolecularFormula:
C16H20N2O4S2
MolecularWeight:
368.471
MdlNumber:
MFCD00025993
Smiles:
Cc1ccc(cc1)S(=O)(=O)NCCNS(=O)(=O)c1ccc(cc1)C
NscNumber:
25018
Complexity:
523
Covalently-bondedUnitCount:
1
HeavyAtomCount:
24
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
2
RotatableBondCount:
7
Xlogp3:
2.3
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Smiles: O=S(=O)(c1ccccc1)NCCNS(=O)(=O)c1ccccc1
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O=S(=O)(c1ccccc1)NCCNS(=O)(=O)c1ccccc1
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Smiles: [O-]S(=O)c1ccc(cc1)Oc1ccc(cc1)S(=O)[O-].[Na+].[Na+]
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[O-]S(=O)c1ccc(cc1)Oc1ccc(cc1)S(=O)[O-].[Na+].[Na+]
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Smiles: O=C1CC[C@@]2(N1)CC[C@@](NC2)(CO[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)c1ccccc1
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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=C1CC[C@@]2(N1)CC[C@@](NC2)(CO[C@@H](c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)c1ccccc1
NscNumber:
__
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
__
RotatableBondCount:
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Xlogp3:
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