AH50724
76629-45-3 | 3-Methyl-5-(3-nitrophenyl)-1,2,4-oxadiazole
Manufacturer: A2B Chem
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CatalogNumber
AH50724
ChemicalName
3-Methyl-5-(3-nitrophenyl)-1,2,4-oxadiazole
CasNumber
76629-45-3
MolecularFormula
C9H7N3O3
MolecularWeight
205.1702
MdlNumber
MFCD08443718
Smiles
Cc1noc(n1)c1cccc(c1)[N+](=O)[O-]
Complexity
243
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
5
RotatableBondCount
1
Xlogp3
2
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CatalogNumber: AH50724
ChemicalName: 3-Methyl-5-(3-nitrophenyl)-1,2,4-oxadiazole
CasNumber: 76629-45-3
MolecularFormula: C9H7N3O3
MolecularWeight: 205.1702
MdlNumber: MFCD08443718
Smiles: Cc1noc(n1)c1cccc(c1)[N+](=O)[O-]
Complexity: 243
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 5
RotatableBondCount: 1
Xlogp3: 2
CatalogNumber:
AH50724
ChemicalName:
3-Methyl-5-(3-nitrophenyl)-1,2,4-oxadiazole
CasNumber:
76629-45-3
MolecularFormula:
C9H7N3O3
MolecularWeight:
205.1702
MdlNumber:
MFCD08443718
Smiles:
Cc1noc(n1)c1cccc(c1)[N+](=O)[O-]
Complexity:
243
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
5
RotatableBondCount:
1
Xlogp3:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CNc1ccc(cc1)Br.Cl
Complexity: 77
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CNc1ccc(cc1)Br.Cl
Complexity:
77
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=Cc1c(nc2n1cccc2C)c1ccc(cc1)OC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=Cc1c(nc2n1cccc2C)c1ccc(cc1)OC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AH50727
ChemicalName: 1-(1H-Benzoimidazol-2-yl)ethylamine hydrochloride
CasNumber: 853789-10-3
MolecularFormula: C9H12ClN3
MolecularWeight: 197.66468
MdlNumber: MFCD08445279
Smiles: CC(c1nc2c([nH]1)cccc2)N.Cl
Complexity: 160
Covalently-bondedUnitCount: 2
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
Xlogp3: __
CatalogNumber:
AH50727
ChemicalName:
1-(1H-Benzoimidazol-2-yl)ethylamine hydrochloride
CasNumber:
853789-10-3
MolecularFormula:
C9H12ClN3
MolecularWeight:
197.66468
MdlNumber:
MFCD08445279
Smiles:
CC(c1nc2c([nH]1)cccc2)N.Cl
Complexity:
160
Covalently-bondedUnitCount:
2
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
Xlogp3:
__