AA40687
1311197-92-8 | 4-Bromo-N-methyl-2-nitro-5-propoxyaniline
Manufacturer: A2B Chem
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CatalogNumber
AA40687
ChemicalName
4-Bromo-N-methyl-2-nitro-5-propoxyaniline
CasNumber
1311197-92-8
MolecularFormula
C10H13BrN2O3
MolecularWeight
289.1258
MdlNumber
MFCD19237156
Smiles
CCCOc1cc(NC)c(cc1Br)[N+](=O)[O-]
Complexity
235
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
4
Xlogp3
3.8
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CatalogNumber: AA40687
ChemicalName: 4-Bromo-N-methyl-2-nitro-5-propoxyaniline
CasNumber: 1311197-92-8
MolecularFormula: C10H13BrN2O3
MolecularWeight: 289.1258
MdlNumber: MFCD19237156
Smiles: CCCOc1cc(NC)c(cc1Br)[N+](=O)[O-]
Complexity: 235
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 3.8
CatalogNumber:
AA40687
ChemicalName:
4-Bromo-N-methyl-2-nitro-5-propoxyaniline
CasNumber:
1311197-92-8
MolecularFormula:
C10H13BrN2O3
MolecularWeight:
289.1258
MdlNumber:
MFCD19237156
Smiles:
CCCOc1cc(NC)c(cc1Br)[N+](=O)[O-]
Complexity:
235
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
3.8
CatalogNumber: AA40688
ChemicalName: 1-(4-Bromo-2-fluorophenyl)pentan-1-one
CasNumber: 1311197-91-7
MolecularFormula: C11H12BrFO
MolecularWeight: 259.1148
MdlNumber: MFCD19237235
Smiles: CCCCC(=O)c1ccc(cc1F)Br
Complexity: 196
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 4
Xlogp3: 3.8
CatalogNumber:
AA40688
ChemicalName:
1-(4-Bromo-2-fluorophenyl)pentan-1-one
CasNumber:
1311197-91-7
MolecularFormula:
C11H12BrFO
MolecularWeight:
259.1148
MdlNumber:
MFCD19237235
Smiles:
CCCCC(=O)c1ccc(cc1F)Br
Complexity:
196
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
4
Xlogp3:
3.8
CatalogNumber: AA40689
ChemicalName: 6-Bromo-3-cyclopropyl-1H-indazole
CasNumber: 1311197-90-6
MolecularFormula: C10H9BrN2
MolecularWeight: 237.0959
MdlNumber: MFCD19237233
Smiles: Brc1ccc2c(c1)[nH]nc2C1CC1
Complexity: 205
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 1
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.8
CatalogNumber:
AA40689
ChemicalName:
6-Bromo-3-cyclopropyl-1H-indazole
CasNumber:
1311197-90-6
MolecularFormula:
C10H9BrN2
MolecularWeight:
237.0959
MdlNumber:
MFCD19237233
Smiles:
Brc1ccc2c(c1)[nH]nc2C1CC1
Complexity:
205
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
1
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.8
CatalogNumber: AA40690
ChemicalName: N-(5-Bromopyrimidin-2-yl)-N-(methoxymethyl)methanesulfonamide
CasNumber: 1311197-89-3
MolecularFormula: C7H10BrN3O3S
MolecularWeight: 296.1416
MdlNumber: MFCD19237228
Smiles: COCN(S(=O)(=O)C)c1ncc(cn1)Br
Complexity: 284
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: __
RotatableBondCount: 4
Xlogp3: 0.3
CatalogNumber:
AA40690
ChemicalName:
N-(5-Bromopyrimidin-2-yl)-N-(methoxymethyl)methanesulfonamide
CasNumber:
1311197-89-3
MolecularFormula:
C7H10BrN3O3S
MolecularWeight:
296.1416
MdlNumber:
MFCD19237228
Smiles:
COCN(S(=O)(=O)C)c1ncc(cn1)Br
Complexity:
284
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
__
RotatableBondCount:
4
Xlogp3:
0.3