AB46265
152459-95-5 | Imatinib
Manufacturer: A2B Chem
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CatalogNumber
AB46265
ChemicalName
Imatinib
CasNumber
152459-95-5
MolecularFormula
C29H31N7O
MolecularWeight
493.6027
MdlNumber
MFCD05662257
Smiles
CN1CCN(CC1)Cc1ccc(cc1)C(=O)Nc1ccc(c(c1)Nc1nccc(n1)c1cccnc1)C
Complexity
706
Covalently-bondedUnitCount
1
HeavyAtomCount
37
HydrogenBondAcceptorCount
7
HydrogenBondDonorCount
2
RotatableBondCount
7
Xlogp3
3.5
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CatalogNumber: AB46265
ChemicalName: Imatinib
CasNumber: 152459-95-5
MolecularFormula: C29H31N7O
MolecularWeight: 493.6027
MdlNumber: MFCD05662257
Smiles: CN1CCN(CC1)Cc1ccc(cc1)C(=O)Nc1ccc(c(c1)Nc1nccc(n1)c1cccnc1)C
Complexity: 706
Covalently-bondedUnitCount: 1
HeavyAtomCount: 37
HydrogenBondAcceptorCount: 7
HydrogenBondDonorCount: 2
RotatableBondCount: 7
Xlogp3: 3.5
CatalogNumber:
AB46265
ChemicalName:
Imatinib
CasNumber:
152459-95-5
MolecularFormula:
C29H31N7O
MolecularWeight:
493.6027
MdlNumber:
MFCD05662257
Smiles:
CN1CCN(CC1)Cc1ccc(cc1)C(=O)Nc1ccc(c(c1)Nc1nccc(n1)c1cccnc1)C
Complexity:
706
Covalently-bondedUnitCount:
1
HeavyAtomCount:
37
HydrogenBondAcceptorCount:
7
HydrogenBondDonorCount:
2
RotatableBondCount:
7
Xlogp3:
3.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CS(=O)(=O)O.CN1CCN(CC1)Cc1ccc(cc1)C(=O)Nc1ccc(c(c1)Nc1nccc(n1)c1cccnc1)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CS(=O)(=O)O.CN1CCN(CC1)Cc1ccc(cc1)C(=O)Nc1ccc(c(c1)Nc1nccc(n1)c1cccnc1)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB46267
ChemicalName: Imazodan
CasNumber: 84243-58-3
MolecularFormula: C13H12N4O
MolecularWeight: 240.2606
MdlNumber: MFCD00867109
Smiles: O=C1CCC(=NN1)c1ccc(cc1)n1cncc1
Complexity: 347
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 0.7
CatalogNumber:
AB46267
ChemicalName:
Imazodan
CasNumber:
84243-58-3
MolecularFormula:
C13H12N4O
MolecularWeight:
240.2606
MdlNumber:
MFCD00867109
Smiles:
O=C1CCC(=NN1)c1ccc(cc1)n1cncc1
Complexity:
347
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
0.7
CatalogNumber: AB46268
ChemicalName: Imidazo[1,2-a]pyridine-3-carbaldehyde
CasNumber: 6188-43-8
MolecularFormula: C8H6N2O
MolecularWeight: 146.146
MdlNumber: MFCD07778354
Smiles: O=Cc1cnc2n1cccc2
Complexity: 160
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: 1.6
CatalogNumber:
AB46268
ChemicalName:
Imidazo[1,2-a]pyridine-3-carbaldehyde
CasNumber:
6188-43-8
MolecularFormula:
C8H6N2O
MolecularWeight:
146.146
MdlNumber:
MFCD07778354
Smiles:
O=Cc1cnc2n1cccc2
Complexity:
160
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
1.6