AA36489
1261998-84-8 | 2-[Benzo(b)thiophen-2-yl]-5-hydroxypyridine
Manufacturer: A2B Chem
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CatalogNumber
AA36489
ChemicalName
2-[Benzo(b)thiophen-2-yl]-5-hydroxypyridine
CasNumber
1261998-84-8
MolecularFormula
C13H9NOS
MolecularWeight
227.2817
MdlNumber
MFCD18323585
Smiles
Oc1ccc(nc1)c1cc2c(s1)cccc2
Complexity
248
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
3.2
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CatalogNumber: AA36489
ChemicalName: 2-[Benzo(b)thiophen-2-yl]-5-hydroxypyridine
CasNumber: 1261998-84-8
MolecularFormula: C13H9NOS
MolecularWeight: 227.2817
MdlNumber: MFCD18323585
Smiles: Oc1ccc(nc1)c1cc2c(s1)cccc2
Complexity: 248
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 3.2
CatalogNumber:
AA36489
ChemicalName:
2-[Benzo(b)thiophen-2-yl]-5-hydroxypyridine
CasNumber:
1261998-84-8
MolecularFormula:
C13H9NOS
MolecularWeight:
227.2817
MdlNumber:
MFCD18323585
Smiles:
Oc1ccc(nc1)c1cc2c(s1)cccc2
Complexity:
248
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
3.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Fc1cccc(c1c1cncc(c1)C(=O)O)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
Fc1cccc(c1c1cncc(c1)C(=O)O)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
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Xlogp3:
__
CatalogNumber: AA36491
ChemicalName: 4-(4-Chloro-3-methoxycarbonylphenyl)benzoic acid
CasNumber: 1261998-46-2
MolecularFormula: C15H10ClO4
MolecularWeight: 289.6905
MdlNumber: MFCD18312737
Smiles: COC(=O)c1cc(ccc1Cl)c1ccc(cc1)C(=O)[O-]
Complexity: 363
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 3.5
CatalogNumber:
AA36491
ChemicalName:
4-(4-Chloro-3-methoxycarbonylphenyl)benzoic acid
CasNumber:
1261998-46-2
MolecularFormula:
C15H10ClO4
MolecularWeight:
289.6905
MdlNumber:
MFCD18312737
Smiles:
COC(=O)c1cc(ccc1Cl)c1ccc(cc1)C(=O)[O-]
Complexity:
363
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
3.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: N#Cc1ccc(c(c1)c1ccc(cc1)O)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
N#Cc1ccc(c(c1)c1ccc(cc1)O)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__