AF36951
25283-96-9 | 5-Methyl-3-(4-nitrophenyl)-1,2,4-oxadiazole
Manufacturer: A2B Chem
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CatalogNumber
AF36951
ChemicalName
5-Methyl-3-(4-nitrophenyl)-1,2,4-oxadiazole
CasNumber
25283-96-9
MolecularFormula
C9H7N3O3
MolecularWeight
205.1702
MdlNumber
MFCD00452242
Smiles
Cc1onc(n1)c1ccc(cc1)[N+](=O)[O-]
Complexity
235
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
5
RotatableBondCount
1
Xlogp3
2.2
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CatalogNumber: AF36951
ChemicalName: 5-Methyl-3-(4-nitrophenyl)-1,2,4-oxadiazole
CasNumber: 25283-96-9
MolecularFormula: C9H7N3O3
MolecularWeight: 205.1702
MdlNumber: MFCD00452242
Smiles: Cc1onc(n1)c1ccc(cc1)[N+](=O)[O-]
Complexity: 235
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 5
RotatableBondCount: 1
Xlogp3: 2.2
CatalogNumber:
AF36951
ChemicalName:
5-Methyl-3-(4-nitrophenyl)-1,2,4-oxadiazole
CasNumber:
25283-96-9
MolecularFormula:
C9H7N3O3
MolecularWeight:
205.1702
MdlNumber:
MFCD00452242
Smiles:
Cc1onc(n1)c1ccc(cc1)[N+](=O)[O-]
Complexity:
235
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
5
RotatableBondCount:
1
Xlogp3:
2.2
CatalogNumber: AF36952
ChemicalName: 1-(Ethanesulfonyl)-2-nitrobenzene
CasNumber: 2976-33-2
MolecularFormula: C8H9NO4S
MolecularWeight: 215.2264
MdlNumber: MFCD24448798
Smiles: CCS(=O)(=O)c1ccccc1[N+](=O)[O-]
Complexity: 300
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
RotatableBondCount: 2
Xlogp3: 1.4
CatalogNumber:
AF36952
ChemicalName:
1-(Ethanesulfonyl)-2-nitrobenzene
CasNumber:
2976-33-2
MolecularFormula:
C8H9NO4S
MolecularWeight:
215.2264
MdlNumber:
MFCD24448798
Smiles:
CCS(=O)(=O)c1ccccc1[N+](=O)[O-]
Complexity:
300
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
RotatableBondCount:
2
Xlogp3:
1.4
CatalogNumber: AF36953
ChemicalName: 1,4-Dioxaspiro[4.5]decan-8-yl 4-methylbenzenesulfonate
CasNumber: 23511-05-9
MolecularFormula: C15H20O5S
MolecularWeight: 312.3813
MdlNumber: MFCD18429461
Smiles: Cc1ccc(cc1)S(=O)(=O)OC1CCC2(CC1)OCCO2
Complexity: 431
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 5
RotatableBondCount: 3
Xlogp3: 2.3
CatalogNumber:
AF36953
ChemicalName:
1,4-Dioxaspiro[4.5]decan-8-yl 4-methylbenzenesulfonate
CasNumber:
23511-05-9
MolecularFormula:
C15H20O5S
MolecularWeight:
312.3813
MdlNumber:
MFCD18429461
Smiles:
Cc1ccc(cc1)S(=O)(=O)OC1CCC2(CC1)OCCO2
Complexity:
431
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
5
RotatableBondCount:
3
Xlogp3:
2.3
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Smiles: NC(=N)NCCC[C@H](C(=O)O)NC(=O)OCC1c2ccccc2-c2c1cccc2.Cl
Complexity: __
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Smiles:
NC(=N)NCCC[C@H](C(=O)O)NC(=O)OCC1c2ccccc2-c2c1cccc2.Cl
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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