AF87956
3723-70-4 | N-Benzyl-3-nitropyridin-2-amine
Manufacturer: A2B Chem
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CatalogNumber
AF87956
ChemicalName
N-Benzyl-3-nitropyridin-2-amine
CasNumber
3723-70-4
MolecularFormula
C12H11N3O2
MolecularWeight
229.2346
MdlNumber
MFCD00499525
Smiles
[O-][N+](=O)c1cccnc1NCc1ccccc1
Complexity
249
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
3
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CatalogNumber: AF87956
ChemicalName: N-Benzyl-3-nitropyridin-2-amine
CasNumber: 3723-70-4
MolecularFormula: C12H11N3O2
MolecularWeight: 229.2346
MdlNumber: MFCD00499525
Smiles: [O-][N+](=O)c1cccnc1NCc1ccccc1
Complexity: 249
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 3
CatalogNumber:
AF87956
ChemicalName:
N-Benzyl-3-nitropyridin-2-amine
CasNumber:
3723-70-4
MolecularFormula:
C12H11N3O2
MolecularWeight:
229.2346
MdlNumber:
MFCD00499525
Smiles:
[O-][N+](=O)c1cccnc1NCc1ccccc1
Complexity:
249
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
3
CatalogNumber: AF87957
ChemicalName: 1-Ethyl-3-(trifluoromethyl)pyrazole
CasNumber: 362640-54-8
MolecularFormula: C6H7F3N2
MolecularWeight: 164.1284
MdlNumber: MFCD15976388
Smiles: CCn1ccc(n1)C(F)(F)F
Complexity: 134
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: 1.5
CatalogNumber:
AF87957
ChemicalName:
1-Ethyl-3-(trifluoromethyl)pyrazole
CasNumber:
362640-54-8
MolecularFormula:
C6H7F3N2
MolecularWeight:
164.1284
MdlNumber:
MFCD15976388
Smiles:
CCn1ccc(n1)C(F)(F)F
Complexity:
134
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
1.5
CatalogNumber: AF87958
ChemicalName: N-BOC 2-Bromo-4-methylaniline
CasNumber: 364607-53-4
MolecularFormula: C12H16BrNO2
MolecularWeight: 286.1649
MdlNumber: MFCD11976466
Smiles: O=C(OC(C)(C)C)Nc1ccc(cc1Br)C
Complexity: 250
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 3.5
CatalogNumber:
AF87958
ChemicalName:
N-BOC 2-Bromo-4-methylaniline
CasNumber:
364607-53-4
MolecularFormula:
C12H16BrNO2
MolecularWeight:
286.1649
MdlNumber:
MFCD11976466
Smiles:
O=C(OC(C)(C)C)Nc1ccc(cc1Br)C
Complexity:
250
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
3.5
CatalogNumber: AF87959
ChemicalName: 1-Boc-4-(Cbz-Aminomethylcarbonyl)piperazine
CasNumber: 353495-62-2
MolecularFormula: C19H27N3O5
MolecularWeight: 377.4348
MdlNumber: MFCD22549303
Smiles: O=C(N1CCN(CC1)C(=O)OC(C)(C)C)CNC(=O)OCc1ccccc1
Complexity: 518
Covalently-bondedUnitCount: 1
HeavyAtomCount: 27
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 7
Xlogp3: 1.6
CatalogNumber:
AF87959
ChemicalName:
1-Boc-4-(Cbz-Aminomethylcarbonyl)piperazine
CasNumber:
353495-62-2
MolecularFormula:
C19H27N3O5
MolecularWeight:
377.4348
MdlNumber:
MFCD22549303
Smiles:
O=C(N1CCN(CC1)C(=O)OC(C)(C)C)CNC(=O)OCc1ccccc1
Complexity:
518
Covalently-bondedUnitCount:
1
HeavyAtomCount:
27
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
7
Xlogp3:
1.6