AA55673
122320-73-4 | 5-[(4-{2-[methyl(pyridin-2-yl)amino]ethoxy}phenyl)methyl]-1,3-thiazolidine-2,4-dione
Manufacturer: A2B Chem
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CatalogNumber
AA55673
ChemicalName
5-[(4-{2-[methyl(pyridin-2-yl)amino]ethoxy}phenyl)methyl]-1,3-thiazolidine-2,4-dione
CasNumber
122320-73-4
MolecularFormula
C18H19N3O3S
MolecularWeight
357.4268
MdlNumber
MFCD00871760
Smiles
O=C1NC(=O)C(S1)Cc1ccc(cc1)OCCN(c1ccccn1)C
NscNumber
758698
Complexity
469
Covalently-bondedUnitCount
1
HeavyAtomCount
25
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
1
RotatableBondCount
7
UndefinedAtomStereocenterCount
1
Xlogp3
3.1
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CatalogNumber: AA55673
ChemicalName: 5-[(4-{2-[methyl(pyridin-2-yl)amino]ethoxy}phenyl)methyl]-1,3-thiazolidine-2,4-dione
CasNumber: 122320-73-4
MolecularFormula: C18H19N3O3S
MolecularWeight: 357.4268
MdlNumber: MFCD00871760
Smiles: O=C1NC(=O)C(S1)Cc1ccc(cc1)OCCN(c1ccccn1)C
NscNumber: 758698
Complexity: 469
Covalently-bondedUnitCount: 1
HeavyAtomCount: 25
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: 7
UndefinedAtomStereocenterCount: 1
Xlogp3: 3.1
CatalogNumber:
AA55673
ChemicalName:
5-[(4-{2-[methyl(pyridin-2-yl)amino]ethoxy}phenyl)methyl]-1,3-thiazolidine-2,4-dione
CasNumber:
122320-73-4
MolecularFormula:
C18H19N3O3S
MolecularWeight:
357.4268
MdlNumber:
MFCD00871760
Smiles:
O=C1NC(=O)C(S1)Cc1ccc(cc1)OCCN(c1ccccn1)C
NscNumber:
758698
Complexity:
469
Covalently-bondedUnitCount:
1
HeavyAtomCount:
25
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
7
UndefinedAtomStereocenterCount:
1
Xlogp3:
3.1
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Smiles: O=[Bi]O[Ti](=O)O[Ti](=O)O[Ti](=O)O[Ti](=O)O[Bi]=O
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Complexity: __
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RotatableBondCount: __
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Smiles:
O=[Bi]O[Ti](=O)O[Ti](=O)O[Ti](=O)O[Ti](=O)O[Bi]=O
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
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Smiles: [Na]O[Bi](=O)=O
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Complexity: 49.8
Covalently-bondedUnitCount: __
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HydrogenBondAcceptorCount: __
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__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[Na]O[Bi](=O)=O
NscNumber:
__
Complexity:
49.8
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
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MolecularFormula: __
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Smiles: N#Cc1cc(Br)ccc1C(=O)O
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
N#Cc1cc(Br)ccc1C(=O)O
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__