AG70809
59944-76-2 | Thieno[2,3-b]pyridine-2-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AG70809
ChemicalName
Thieno[2,3-b]pyridine-2-carboxylic acid
CasNumber
59944-76-2
MolecularFormula
C8H5NO2S
MolecularWeight
179.1958
MdlNumber
MFCD07371381
Smiles
OC(=O)c1cc2c(s1)nccc2
Complexity
198
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
2.1
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CatalogNumber: AG70809
ChemicalName: Thieno[2,3-b]pyridine-2-carboxylic acid
CasNumber: 59944-76-2
MolecularFormula: C8H5NO2S
MolecularWeight: 179.1958
MdlNumber: MFCD07371381
Smiles: OC(=O)c1cc2c(s1)nccc2
Complexity: 198
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.1
CatalogNumber:
AG70809
ChemicalName:
Thieno[2,3-b]pyridine-2-carboxylic acid
CasNumber:
59944-76-2
MolecularFormula:
C8H5NO2S
MolecularWeight:
179.1958
MdlNumber:
MFCD07371381
Smiles:
OC(=O)c1cc2c(s1)nccc2
Complexity:
198
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.1
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MolecularFormula: __
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Smiles: C1=CC=C(C=C1)OCC2=CC=C(C=C2)C(=O)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
C1=CC=C(C=C1)OCC2=CC=C(C=C2)C(=O)Cl
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
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RotatableBondCount:
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Smiles: ClCc1ccc(cc1)c1ccc(cn1)C(F)(F)F
Complexity: __
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Smiles:
ClCc1ccc(cc1)c1ccc(cn1)C(F)(F)F
Complexity:
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Smiles: CC(c1nc2c(s1)CCCC2)N.Cl.Cl
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(c1nc2c(s1)CCCC2)N.Cl.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__