AD81238
893723-57-4 | 2-(Thiophen-2-yl)Isonicotinic acid
Manufacturer: A2B Chem
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CatalogNumber
AD81238
ChemicalName
2-(Thiophen-2-yl)Isonicotinic acid
CasNumber
893723-57-4
MolecularFormula
C10H7NO2S
MolecularWeight
205.2331
MdlNumber
MFCD06496472
Smiles
OC(=O)c1ccnc(c1)c1cccs1
Complexity
222
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
1.8
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CatalogNumber: AD81238
ChemicalName: 2-(Thiophen-2-yl)Isonicotinic acid
CasNumber: 893723-57-4
MolecularFormula: C10H7NO2S
MolecularWeight: 205.2331
MdlNumber: MFCD06496472
Smiles: OC(=O)c1ccnc(c1)c1cccs1
Complexity: 222
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.8
CatalogNumber:
AD81238
ChemicalName:
2-(Thiophen-2-yl)Isonicotinic acid
CasNumber:
893723-57-4
MolecularFormula:
C10H7NO2S
MolecularWeight:
205.2331
MdlNumber:
MFCD06496472
Smiles:
OC(=O)c1ccnc(c1)c1cccs1
Complexity:
222
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.8
CatalogNumber: __
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MolecularFormula: __
MolecularWeight: __
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Smiles: O=C([C@@H](N[C@H](C(=O)O)C)CCc1ccccc1)OCc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
O=C([C@@H](N[C@H](C(=O)O)C)CCc1ccccc1)OCc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
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MolecularFormula: __
MolecularWeight: __
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Smiles: CCOC(=O)c1ccc2c(c1)c1ccccc1n2C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
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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:
CCOC(=O)c1ccc2c(c1)c1ccccc1n2C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COCOc1cc(ccc1C)C(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COCOc1cc(ccc1C)C(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__