AD36906
387867-13-2 | Tandutinib
Manufacturer: A2B Chem
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CatalogNumber
AD36906
ChemicalName
Tandutinib
CasNumber
387867-13-2
MolecularFormula
C31H42N6O4
MolecularWeight
562.703
MdlNumber
MFCD09954147
Smiles
COc1cc2c(cc1OCCCN1CCCCC1)ncnc2N1CCN(CC1)C(=O)Nc1ccc(cc1)OC(C)C
Complexity
783
Covalently-bondedUnitCount
1
HeavyAtomCount
41
HydrogenBondAcceptorCount
8
HydrogenBondDonorCount
1
RotatableBondCount
10
Xlogp3
4.6
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CatalogNumber: AD36906
ChemicalName: Tandutinib
CasNumber: 387867-13-2
MolecularFormula: C31H42N6O4
MolecularWeight: 562.703
MdlNumber: MFCD09954147
Smiles: COc1cc2c(cc1OCCCN1CCCCC1)ncnc2N1CCN(CC1)C(=O)Nc1ccc(cc1)OC(C)C
Complexity: 783
Covalently-bondedUnitCount: 1
HeavyAtomCount: 41
HydrogenBondAcceptorCount: 8
HydrogenBondDonorCount: 1
RotatableBondCount: 10
Xlogp3: 4.6
CatalogNumber:
AD36906
ChemicalName:
Tandutinib
CasNumber:
387867-13-2
MolecularFormula:
C31H42N6O4
MolecularWeight:
562.703
MdlNumber:
MFCD09954147
Smiles:
COc1cc2c(cc1OCCCN1CCCCC1)ncnc2N1CCN(CC1)C(=O)Nc1ccc(cc1)OC(C)C
Complexity:
783
Covalently-bondedUnitCount:
1
HeavyAtomCount:
41
HydrogenBondAcceptorCount:
8
HydrogenBondDonorCount:
1
RotatableBondCount:
10
Xlogp3:
4.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C=CCOC(=O)NCC[C@H](C(=O)O)NC(=O)OCC1c2ccccc2-c2c1cccc2
Complexity: 632
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 3.4
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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Smiles:
C=CCOC(=O)NCC[C@H](C(=O)O)NC(=O)OCC1c2ccccc2-c2c1cccc2
Complexity:
632
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
3.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)C(NC(=O)OCc1ccccc1)C#N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
CCOC(=O)C(NC(=O)OCc1ccccc1)C#N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C#CCOc1ccccc1Br
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C#CCOc1ccccc1Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__