AI40349
1820619-18-8 | 1-(Ethanesulfonyl)imidazole
Manufacturer: A2B Chem
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CatalogNumber
AI40349
ChemicalName
1-(Ethanesulfonyl)imidazole
CasNumber
1820619-18-8
MolecularFormula
C5H8N2O2S
MolecularWeight
160.1942
MdlNumber
MFCD25953909
Smiles
CCS(=O)(=O)n1cncc1
Complexity
194
Covalently-bondedUnitCount
1
HeavyAtomCount
10
HydrogenBondAcceptorCount
3
RotatableBondCount
2
Xlogp3
0.1
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CatalogNumber: AI40349
ChemicalName: 1-(Ethanesulfonyl)imidazole
CasNumber: 1820619-18-8
MolecularFormula: C5H8N2O2S
MolecularWeight: 160.1942
MdlNumber: MFCD25953909
Smiles: CCS(=O)(=O)n1cncc1
Complexity: 194
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 0.1
CatalogNumber:
AI40349
ChemicalName:
1-(Ethanesulfonyl)imidazole
CasNumber:
1820619-18-8
MolecularFormula:
C5H8N2O2S
MolecularWeight:
160.1942
MdlNumber:
MFCD25953909
Smiles:
CCS(=O)(=O)n1cncc1
Complexity:
194
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
0.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(=O)C1=CC=CC(=C1)C2=C(C=C(C=C2)C(=O)OC)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(=O)C1=CC=CC(=C1)C2=C(C=C(C=C2)C(=O)OC)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(C)COC1=C(C=CC(=C1)C(=O)OC)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(C)COC1=C(C=CC(=C1)C(=O)OC)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AI40354
ChemicalName: Methyl 6-(2,4-difluorophenyl)pyridine-2-carboxylate
CasNumber: 1820619-37-1
MolecularFormula: C13H9F2NO2
MolecularWeight: 249.2129
MdlNumber: MFCD27981348
Smiles: COC(=O)c1cccc(n1)c1ccc(cc1F)F
Complexity: 301
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 5
RotatableBondCount: 3
Xlogp3: 2.9
CatalogNumber:
AI40354
ChemicalName:
Methyl 6-(2,4-difluorophenyl)pyridine-2-carboxylate
CasNumber:
1820619-37-1
MolecularFormula:
C13H9F2NO2
MolecularWeight:
249.2129
MdlNumber:
MFCD27981348
Smiles:
COC(=O)c1cccc(n1)c1ccc(cc1F)F
Complexity:
301
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
5
RotatableBondCount:
3
Xlogp3:
2.9