AF85574
313562-28-6 | 5-Bromo-N-phenylnicotinamide
Manufacturer: A2B Chem
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CatalogNumber
AF85574
ChemicalName
5-Bromo-N-phenylnicotinamide
CasNumber
313562-28-6
MolecularFormula
C12H9BrN2O
MolecularWeight
277.1167
MdlNumber
MFCD00806104
Smiles
Brc1cncc(c1)C(=O)Nc1ccccc1
Complexity
241
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
2.4
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CatalogNumber: AF85574
ChemicalName: 5-Bromo-N-phenylnicotinamide
CasNumber: 313562-28-6
MolecularFormula: C12H9BrN2O
MolecularWeight: 277.1167
MdlNumber: MFCD00806104
Smiles: Brc1cncc(c1)C(=O)Nc1ccccc1
Complexity: 241
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.4
CatalogNumber:
AF85574
ChemicalName:
5-Bromo-N-phenylnicotinamide
CasNumber:
313562-28-6
MolecularFormula:
C12H9BrN2O
MolecularWeight:
277.1167
MdlNumber:
MFCD00806104
Smiles:
Brc1cncc(c1)C(=O)Nc1ccccc1
Complexity:
241
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [O-]C(=O)[C@H](Cc1cc(I)c(c(c1)I)Oc1ccc(c(c1)I)O)N.[Na+].O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[O-]C(=O)[C@H](Cc1cc(I)c(c(c1)I)Oc1ccc(c(c1)I)O)N.[Na+].O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AF85576
ChemicalName: N,N-Dimethyl 4-fluorobenzenesulfonamide
CasNumber: 383-31-3
MolecularFormula: C8H10FNO2S
MolecularWeight: 203.2339
MdlNumber: MFCD01211990
Smiles: CN(S(=O)(=O)c1ccc(cc1)F)C
Complexity: 250
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 2
Xlogp3: 1.5
CatalogNumber:
AF85576
ChemicalName:
N,N-Dimethyl 4-fluorobenzenesulfonamide
CasNumber:
383-31-3
MolecularFormula:
C8H10FNO2S
MolecularWeight:
203.2339
MdlNumber:
MFCD01211990
Smiles:
CN(S(=O)(=O)c1ccc(cc1)F)C
Complexity:
250
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
2
Xlogp3:
1.5
CatalogNumber: AF85577
ChemicalName: 3-Bromo-5-nitrobenzohydrazide
CasNumber: 374671-07-5
MolecularFormula: C7H6BrN3O3
MolecularWeight: 260.0448
MdlNumber: MFCD09972132
Smiles: NNC(=O)c1cc(Br)cc(c1)[N+](=O)[O-]
Complexity: 243
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 0.9
CatalogNumber:
AF85577
ChemicalName:
3-Bromo-5-nitrobenzohydrazide
CasNumber:
374671-07-5
MolecularFormula:
C7H6BrN3O3
MolecularWeight:
260.0448
MdlNumber:
MFCD09972132
Smiles:
NNC(=O)c1cc(Br)cc(c1)[N+](=O)[O-]
Complexity:
243
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
0.9