AA33081
1198-99-8 | 3-(Pyridin-3-yl)-4,5-dihydro-1,2,4-oxadiazol-5-one
Manufacturer: A2B Chem
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CatalogNumber
AA33081
ChemicalName
3-(Pyridin-3-yl)-4,5-dihydro-1,2,4-oxadiazol-5-one
CasNumber
1198-99-8
MolecularFormula
C7H5N3O2
MolecularWeight
163.1335
MdlNumber
MFCD12815751
Smiles
O=c1o[nH]c(n1)c1cccnc1
Complexity
227
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
0.4
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CatalogNumber: AA33081
ChemicalName: 3-(Pyridin-3-yl)-4,5-dihydro-1,2,4-oxadiazol-5-one
CasNumber: 1198-99-8
MolecularFormula: C7H5N3O2
MolecularWeight: 163.1335
MdlNumber: MFCD12815751
Smiles: O=c1o[nH]c(n1)c1cccnc1
Complexity: 227
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 0.4
CatalogNumber:
AA33081
ChemicalName:
3-(Pyridin-3-yl)-4,5-dihydro-1,2,4-oxadiazol-5-one
CasNumber:
1198-99-8
MolecularFormula:
C7H5N3O2
MolecularWeight:
163.1335
MdlNumber:
MFCD12815751
Smiles:
O=c1o[nH]c(n1)c1cccnc1
Complexity:
227
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
0.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Cc1onc(n1)c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Cc1onc(n1)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AA33083
ChemicalName: 4-Phenyl-2-pyrrolidone
CasNumber: 1198-97-6
MolecularFormula: C10H11NO
MolecularWeight: 161.2004
MdlNumber: MFCD01687226
Smiles: O=C1NCC(C1)c1ccccc1
Complexity: 173
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1
CatalogNumber:
AA33083
ChemicalName:
4-Phenyl-2-pyrrolidone
CasNumber:
1198-97-6
MolecularFormula:
C10H11NO
MolecularWeight:
161.2004
MdlNumber:
MFCD01687226
Smiles:
O=C1NCC(C1)c1ccccc1
Complexity:
173
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC1(C)CCc2c(O1)cccc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC1(C)CCc2c(O1)cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__