AH94142
90357-06-5 | Bicalutamide
Manufacturer: A2B Chem
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CatalogNumber
AH94142
ChemicalName
Bicalutamide
CasNumber
90357-06-5
MolecularFormula
C18H14F4N2O4S
MolecularWeight
430.3733727999999
MdlNumber
MFCD00869971
Smiles
N#Cc1ccc(cc1C(F)(F)F)NC(=O)C(CS(=O)(=O)c1ccc(cc1)F)(O)C
Complexity
750
Covalently-bondedUnitCount
1
HeavyAtomCount
29
HydrogenBondAcceptorCount
9
HydrogenBondDonorCount
2
RotatableBondCount
5
UndefinedAtomStereocenterCount
1
Xlogp3
2.3
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CatalogNumber: AH94142
ChemicalName: Bicalutamide
CasNumber: 90357-06-5
MolecularFormula: C18H14F4N2O4S
MolecularWeight: 430.3733727999999
MdlNumber: MFCD00869971
Smiles: N#Cc1ccc(cc1C(F)(F)F)NC(=O)C(CS(=O)(=O)c1ccc(cc1)F)(O)C
Complexity: 750
Covalently-bondedUnitCount: 1
HeavyAtomCount: 29
HydrogenBondAcceptorCount: 9
HydrogenBondDonorCount: 2
RotatableBondCount: 5
UndefinedAtomStereocenterCount: 1
Xlogp3: 2.3
CatalogNumber:
AH94142
ChemicalName:
Bicalutamide
CasNumber:
90357-06-5
MolecularFormula:
C18H14F4N2O4S
MolecularWeight:
430.3733727999999
MdlNumber:
MFCD00869971
Smiles:
N#Cc1ccc(cc1C(F)(F)F)NC(=O)C(CS(=O)(=O)c1ccc(cc1)F)(O)C
Complexity:
750
Covalently-bondedUnitCount:
1
HeavyAtomCount:
29
HydrogenBondAcceptorCount:
9
HydrogenBondDonorCount:
2
RotatableBondCount:
5
UndefinedAtomStereocenterCount:
1
Xlogp3:
2.3
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Smiles: CC(=C)CC(C(=O)O)NC(=O)C
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CC(=C)CC(C(=O)O)NC(=O)C
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Smiles: CCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C3CCC(CC3)CCC
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Smiles:
CCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C3CCC(CC3)CCC
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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UndefinedAtomStereocenterCount:
__
Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCCC1CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)CCC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCCC1CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)CCC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__