AA81899
159724-51-3 | 1-(1H-Benzo[d]imidazol-4-yl)ethanone
Manufacturer: A2B Chem
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CatalogNumber
AA81899
ChemicalName
1-(1H-Benzo[d]imidazol-4-yl)ethanone
CasNumber
159724-51-3
MolecularFormula
C9H8N2O
MolecularWeight
160.1726
MdlNumber
MFCD09263853
Smiles
CC(=O)c1cccc2c1[nH]cn2
Complexity
193
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
1.2
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CatalogNumber: AA81899
ChemicalName: 1-(1H-Benzo[d]imidazol-4-yl)ethanone
CasNumber: 159724-51-3
MolecularFormula: C9H8N2O
MolecularWeight: 160.1726
MdlNumber: MFCD09263853
Smiles: CC(=O)c1cccc2c1[nH]cn2
Complexity: 193
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.2
CatalogNumber:
AA81899
ChemicalName:
1-(1H-Benzo[d]imidazol-4-yl)ethanone
CasNumber:
159724-51-3
MolecularFormula:
C9H8N2O
MolecularWeight:
160.1726
MdlNumber:
MFCD09263853
Smiles:
CC(=O)c1cccc2c1[nH]cn2
Complexity:
193
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.2
CatalogNumber: AA81900
ChemicalName: 3-Morpholin-4-ylaniline
CasNumber: 159724-40-0
MolecularFormula: C10H14N2O
MolecularWeight: 178.231
MdlNumber: MFCD03197165
Smiles: Nc1cccc(c1)N1CCOCC1
Complexity: 157
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 0.7
CatalogNumber:
AA81900
ChemicalName:
3-Morpholin-4-ylaniline
CasNumber:
159724-40-0
MolecularFormula:
C10H14N2O
MolecularWeight:
178.231
MdlNumber:
MFCD03197165
Smiles:
Nc1cccc(c1)N1CCOCC1
Complexity:
157
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
0.7
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Smiles: Oc1ccc2c(c1)C13CCCCC3C(C2)N(CC1)C(=O)OCc1ccccc1
Complexity: __
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Smiles:
Oc1ccc2c(c1)C13CCCCC3C(C2)N(CC1)C(=O)OCc1ccccc1
Complexity:
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Smiles: COC(=O)[C@@H](NCc1ccccc1)C
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MolecularFormula:
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Smiles:
COC(=O)[C@@H](NCc1ccccc1)C
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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Xlogp3:
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