AB56422
153587-01-0 | NS-1619
Manufacturer: A2B Chem
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CatalogNumber
AB56422
ChemicalName
NS-1619
CasNumber
153587-01-0
MolecularFormula
C15H8F6N2O2
MolecularWeight
362.2266
MdlNumber
MFCD00928190
Smiles
Oc1ccc(cc1n1c(=O)[nH]c2c1ccc(c2)C(F)(F)F)C(F)(F)F
Complexity
523
Covalently-bondedUnitCount
1
HeavyAtomCount
25
HydrogenBondAcceptorCount
8
HydrogenBondDonorCount
2
RotatableBondCount
1
Xlogp3
3.7
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CatalogNumber: AB56422
ChemicalName: NS-1619
CasNumber: 153587-01-0
MolecularFormula: C15H8F6N2O2
MolecularWeight: 362.2266
MdlNumber: MFCD00928190
Smiles: Oc1ccc(cc1n1c(=O)[nH]c2c1ccc(c2)C(F)(F)F)C(F)(F)F
Complexity: 523
Covalently-bondedUnitCount: 1
HeavyAtomCount: 25
HydrogenBondAcceptorCount: 8
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 3.7
CatalogNumber:
AB56422
ChemicalName:
NS-1619
CasNumber:
153587-01-0
MolecularFormula:
C15H8F6N2O2
MolecularWeight:
362.2266
MdlNumber:
MFCD00928190
Smiles:
Oc1ccc(cc1n1c(=O)[nH]c2c1ccc(c2)C(F)(F)F)C(F)(F)F
Complexity:
523
Covalently-bondedUnitCount:
1
HeavyAtomCount:
25
HydrogenBondAcceptorCount:
8
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
3.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Fc1ccc(c(c1)C(O)C)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Fc1ccc(c(c1)C(O)C)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB56424
ChemicalName: 2'-Hydroxy-6'-methoxyacetophenone
CasNumber: 703-23-1
MolecularFormula: C9H10O3
MolecularWeight: 166.1739
MdlNumber: MFCD00008732
Smiles: COc1cccc(c1C(=O)C)O
Complexity: 167
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.8
CatalogNumber:
AB56424
ChemicalName:
2'-Hydroxy-6'-methoxyacetophenone
CasNumber:
703-23-1
MolecularFormula:
C9H10O3
MolecularWeight:
166.1739
MdlNumber:
MFCD00008732
Smiles:
COc1cccc(c1C(=O)C)O
Complexity:
167
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OCCN1c2cc(C)ccc2C(CC1(C)C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OCCN1c2cc(C)ccc2C(CC1(C)C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__