AI40558
1820666-05-4 | 6-Bromo-4,5-difluoro-1,3-dihydro-1,3-benzodiazol-2-one
Manufacturer: A2B Chem
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CatalogNumber
AI40558
ChemicalName
6-Bromo-4,5-difluoro-1,3-dihydro-1,3-benzodiazol-2-one
CasNumber
1820666-05-4
MolecularFormula
C7H3BrF2N2O
MolecularWeight
249.0123
MdlNumber
MFCD28101654
Smiles
O=c1[nH]c2c([nH]1)cc(c(c2F)F)Br
Complexity
241
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
Xlogp3
1.5
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CatalogNumber: AI40558
ChemicalName: 6-Bromo-4,5-difluoro-1,3-dihydro-1,3-benzodiazol-2-one
CasNumber: 1820666-05-4
MolecularFormula: C7H3BrF2N2O
MolecularWeight: 249.0123
MdlNumber: MFCD28101654
Smiles: O=c1[nH]c2c([nH]1)cc(c(c2F)F)Br
Complexity: 241
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
Xlogp3: 1.5
CatalogNumber:
AI40558
ChemicalName:
6-Bromo-4,5-difluoro-1,3-dihydro-1,3-benzodiazol-2-one
CasNumber:
1820666-05-4
MolecularFormula:
C7H3BrF2N2O
MolecularWeight:
249.0123
MdlNumber:
MFCD28101654
Smiles:
O=c1[nH]c2c([nH]1)cc(c(c2F)F)Br
Complexity:
241
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
Xlogp3:
1.5
CatalogNumber: AI40559
ChemicalName: 1-(3-Bromophenyl)-N-methyl-5-oxopyrrolidine-3-carboxamide
CasNumber: 1820666-21-4
MolecularFormula: C12H13BrN2O2
MolecularWeight: 297.1478
MdlNumber: MFCD27936849
Smiles: CNC(=O)C1CC(=O)N(C1)c1cccc(c1)Br
Complexity: 322
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
Xlogp3: 1
CatalogNumber:
AI40559
ChemicalName:
1-(3-Bromophenyl)-N-methyl-5-oxopyrrolidine-3-carboxamide
CasNumber:
1820666-21-4
MolecularFormula:
C12H13BrN2O2
MolecularWeight:
297.1478
MdlNumber:
MFCD27936849
Smiles:
CNC(=O)C1CC(=O)N(C1)c1cccc(c1)Br
Complexity:
322
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
Xlogp3:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCn1cc(c(n1)C(F)(F)F)C=O
Complexity: 207
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
Xlogp3: 1.4
CatalogNumber:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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Smiles:
CCCn1cc(c(n1)C(F)(F)F)C=O
Complexity:
207
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
Xlogp3:
1.4
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Smiles: Fc1cccc(c1N)c1c[nH]nc1
Complexity: __
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HydrogenBondAcceptorCount: __
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Xlogp3: __
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CasNumber:
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MolecularFormula:
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Smiles:
Fc1cccc(c1N)c1c[nH]nc1
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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Xlogp3:
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