AG16717
52545-13-8 | 4-Methoxy-2(1H)-pyridinone
Manufacturer: A2B Chem
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CatalogNumber
AG16717
ChemicalName
4-Methoxy-2(1H)-pyridinone
CasNumber
52545-13-8
MolecularFormula
C6H7NO2
MolecularWeight
125.1253
MdlNumber
MFCD09839191
Smiles
COc1cc[nH]c(=O)c1
Complexity
182
Covalently-bondedUnitCount
1
HeavyAtomCount
9
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
-0.1
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CatalogNumber: AG16717
ChemicalName: 4-Methoxy-2(1H)-pyridinone
CasNumber: 52545-13-8
MolecularFormula: C6H7NO2
MolecularWeight: 125.1253
MdlNumber: MFCD09839191
Smiles: COc1cc[nH]c(=O)c1
Complexity: 182
Covalently-bondedUnitCount: 1
HeavyAtomCount: 9
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: -0.1
CatalogNumber:
AG16717
ChemicalName:
4-Methoxy-2(1H)-pyridinone
CasNumber:
52545-13-8
MolecularFormula:
C6H7NO2
MolecularWeight:
125.1253
MdlNumber:
MFCD09839191
Smiles:
COc1cc[nH]c(=O)c1
Complexity:
182
Covalently-bondedUnitCount:
1
HeavyAtomCount:
9
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
-0.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(CCN1C(C)C(=O)Nc2c1nc(Cl)nc2)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(CCN1C(C)C(=O)Nc2c1nc(Cl)nc2)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: FC(C[C@@H](C(=O)O)NC(=O)OC(C)(C)C)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
FC(C[C@@H](C(=O)O)NC(=O)OC(C)(C)C)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AG16720
ChemicalName: Cyclopamine
CasNumber: 4449-51-8
MolecularFormula: C27H41NO2
MolecularWeight: 411.6199
MdlNumber: MFCD09878269
Smiles: O[C@H]1CC[C@]2(C(=CC[C@@H]3[C@@H]2CC2=C(C)[C@]4(CC[C@@H]32)O[C@H]2[C@H]([C@H]4C)NC[C@H](C2)C)C1)C
Complexity: 801
Covalently-bondedUnitCount: 1
HeavyAtomCount: 30
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: __
Xlogp3: 3.5
CatalogNumber:
AG16720
ChemicalName:
Cyclopamine
CasNumber:
4449-51-8
MolecularFormula:
C27H41NO2
MolecularWeight:
411.6199
MdlNumber:
MFCD09878269
Smiles:
O[C@H]1CC[C@]2(C(=CC[C@@H]3[C@@H]2CC2=C(C)[C@]4(CC[C@@H]32)O[C@H]2[C@H]([C@H]4C)NC[C@H](C2)C)C1)C
Complexity:
801
Covalently-bondedUnitCount:
1
HeavyAtomCount:
30
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
__
Xlogp3:
3.5