AI09082
112888-43-4 | 6-(Bromomethyl)-2-methylquinazolin-4(3H)-one
Manufacturer: A2B Chem
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CatalogNumber
AI09082
ChemicalName
6-(Bromomethyl)-2-methylquinazolin-4(3H)-one
CasNumber
112888-43-4
MolecularFormula
C10H9BrN2O
MolecularWeight
253.0953
MdlNumber
MFCD06200810
Smiles
BrCc1ccc2c(c1)c(=O)[nH]c(n2)C
Complexity
277
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
1.3
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CatalogNumber: AI09082
ChemicalName: 6-(Bromomethyl)-2-methylquinazolin-4(3H)-one
CasNumber: 112888-43-4
MolecularFormula: C10H9BrN2O
MolecularWeight: 253.0953
MdlNumber: MFCD06200810
Smiles: BrCc1ccc2c(c1)c(=O)[nH]c(n2)C
Complexity: 277
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.3
CatalogNumber:
AI09082
ChemicalName:
6-(Bromomethyl)-2-methylquinazolin-4(3H)-one
CasNumber:
112888-43-4
MolecularFormula:
C10H9BrN2O
MolecularWeight:
253.0953
MdlNumber:
MFCD06200810
Smiles:
BrCc1ccc2c(c1)c(=O)[nH]c(n2)C
Complexity:
277
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: C#CCNc1ccc(cc1)C(=O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
C#CCNc1ccc(cc1)C(=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: NC(=N)NCCC[C@@H](C(=O)N1CCC[C@H]1C(=O)Nc1ccc(cc1)[N+](=O)[O-])N
Complexity: __
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Smiles:
NC(=N)NCCC[C@@H](C(=O)N1CCC[C@H]1C(=O)Nc1ccc(cc1)[N+](=O)[O-])N
Complexity:
__
Covalently-bondedUnitCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: NCCCNCCSP(=O)(O)O.O.O.O
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
NCCCNCCSP(=O)(O)O.O.O.O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
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