AI11831
1184914-90-6 | 5-Bromo-3-(1-methyl-1H-pyrazol-4-yl)quinoline
Manufacturer: A2B Chem
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CatalogNumber
AI11831
ChemicalName
5-Bromo-3-(1-methyl-1H-pyrazol-4-yl)quinoline
CasNumber
1184914-90-6
MolecularFormula
C13H10BrN3
MolecularWeight
288.1426
MdlNumber
MFCD12405940
Smiles
Cn1ncc(c1)c1cnc2c(c1)c(Br)ccc2
Complexity
273
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
2
RotatableBondCount
1
Xlogp3
2.8
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CatalogNumber: AI11831
ChemicalName: 5-Bromo-3-(1-methyl-1H-pyrazol-4-yl)quinoline
CasNumber: 1184914-90-6
MolecularFormula: C13H10BrN3
MolecularWeight: 288.1426
MdlNumber: MFCD12405940
Smiles: Cn1ncc(c1)c1cnc2c(c1)c(Br)ccc2
Complexity: 273
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
Xlogp3: 2.8
CatalogNumber:
AI11831
ChemicalName:
5-Bromo-3-(1-methyl-1H-pyrazol-4-yl)quinoline
CasNumber:
1184914-90-6
MolecularFormula:
C13H10BrN3
MolecularWeight:
288.1426
MdlNumber:
MFCD12405940
Smiles:
Cn1ncc(c1)c1cnc2c(c1)c(Br)ccc2
Complexity:
273
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
Xlogp3:
2.8
CatalogNumber: AI11832
ChemicalName: 2-Amino-6-bromo-8-isopropyl-4-methylpteridin-7(8H)-one
CasNumber: 1184916-06-0
MolecularFormula: C10H12BrN5O
MolecularWeight: 298.1392
MdlNumber: MFCD12405943
Smiles: N=c1[nH]c(C)c2c(n1)n(C(C)C)c(=O)c(n2)Br
Complexity: 359
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 5
RotatableBondCount: 1
Xlogp3: 1.5
CatalogNumber:
AI11832
ChemicalName:
2-Amino-6-bromo-8-isopropyl-4-methylpteridin-7(8H)-one
CasNumber:
1184916-06-0
MolecularFormula:
C10H12BrN5O
MolecularWeight:
298.1392
MdlNumber:
MFCD12405943
Smiles:
N=c1[nH]c(C)c2c(n1)n(C(C)C)c(=O)c(n2)Br
Complexity:
359
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
5
RotatableBondCount:
1
Xlogp3:
1.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C1=CC(=C(N=C1)C(=O)CBr)O.Br
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C1=CC(=C(N=C1)C(=O)CBr)O.Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AI11834
ChemicalName: Isopropyl 4-(4-formylpyrazol-1-yl)piperidine-1-carboxylate
CasNumber: 1184917-75-6
MolecularFormula: C13H19N3O3
MolecularWeight: 265.3083
MdlNumber: MFCD12407905
Smiles: O=Cc1cnn(c1)C1CCN(CC1)C(=O)OC(C)C
Complexity: 327
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
RotatableBondCount: 4
Xlogp3: 0.9
CatalogNumber:
AI11834
ChemicalName:
Isopropyl 4-(4-formylpyrazol-1-yl)piperidine-1-carboxylate
CasNumber:
1184917-75-6
MolecularFormula:
C13H19N3O3
MolecularWeight:
265.3083
MdlNumber:
MFCD12407905
Smiles:
O=Cc1cnn(c1)C1CCN(CC1)C(=O)OC(C)C
Complexity:
327
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
RotatableBondCount:
4
Xlogp3:
0.9