AI39500
178876-85-2 | methyl 3-bromo-6-acetamidopyridine-2-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AI39500
ChemicalName
methyl 3-bromo-6-acetamidopyridine-2-carboxylate
CasNumber
178876-85-2
MolecularFormula
C9H9BrN2O3
MolecularWeight
273.0834
MdlNumber
MFCD27578199
Smiles
COC(=O)c1nc(ccc1Br)NC(=O)C
Complexity
260
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
1.2
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CatalogNumber: AI39500
ChemicalName: methyl 3-bromo-6-acetamidopyridine-2-carboxylate
CasNumber: 178876-85-2
MolecularFormula: C9H9BrN2O3
MolecularWeight: 273.0834
MdlNumber: MFCD27578199
Smiles: COC(=O)c1nc(ccc1Br)NC(=O)C
Complexity: 260
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 1.2
CatalogNumber:
AI39500
ChemicalName:
methyl 3-bromo-6-acetamidopyridine-2-carboxylate
CasNumber:
178876-85-2
MolecularFormula:
C9H9BrN2O3
MolecularWeight:
273.0834
MdlNumber:
MFCD27578199
Smiles:
COC(=O)c1nc(ccc1Br)NC(=O)C
Complexity:
260
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
1.2
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Smiles: COc1c(OC)cccc1c1ncc[nH]1
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
COc1c(OC)cccc1c1ncc[nH]1
Complexity:
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RotatableBondCount:
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Smiles: NC(=O)c1ccc2c(c1)nccc2Cl
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Smiles:
NC(=O)c1ccc2c(c1)nccc2Cl
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: CC(Oc1ccc(cc1)c1[nH]ccn1)C
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:
CC(Oc1ccc(cc1)c1[nH]ccn1)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
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