AI02705
944390-08-3 | 2-Acetamido-5-chloroisonicotinic acid
Manufacturer: A2B Chem
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CatalogNumber
AI02705
ChemicalName
2-Acetamido-5-chloroisonicotinic acid
CasNumber
944390-08-3
MolecularFormula
C8H7ClN2O3
MolecularWeight
214.6058
MdlNumber
MFCD17015849
Smiles
CC(=O)Nc1ncc(c(c1)C(=O)O)Cl
Complexity
247
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
2
Xlogp3
0.5
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CatalogNumber: AI02705
ChemicalName: 2-Acetamido-5-chloroisonicotinic acid
CasNumber: 944390-08-3
MolecularFormula: C8H7ClN2O3
MolecularWeight: 214.6058
MdlNumber: MFCD17015849
Smiles: CC(=O)Nc1ncc(c(c1)C(=O)O)Cl
Complexity: 247
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: 0.5
CatalogNumber:
AI02705
ChemicalName:
2-Acetamido-5-chloroisonicotinic acid
CasNumber:
944390-08-3
MolecularFormula:
C8H7ClN2O3
MolecularWeight:
214.6058
MdlNumber:
MFCD17015849
Smiles:
CC(=O)Nc1ncc(c(c1)C(=O)O)Cl
Complexity:
247
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
0.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Oc1ccc(c(c1)c1ccc(cc1)Oc1ccccc1)O
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:
Oc1ccc(c(c1)c1ccc(cc1)Oc1ccccc1)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
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MdlNumber: __
Smiles: COc1cccc(c1C=C)C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularFormula:
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MolecularWeight:
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Smiles:
COc1cccc(c1C=C)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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ChemicalName: __
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Smiles: N#Cc1nn(c(c1C#N)N)c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
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:
N#Cc1nn(c(c1C#N)N)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__