AE31586
1060817-67-5 | 3-Methyl-4-oxo-3,4-dihydro-7-quinazolinecarboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AE31586
ChemicalName
3-Methyl-4-oxo-3,4-dihydro-7-quinazolinecarboxylic acid
CasNumber
1060817-67-5
MolecularFormula
C10H8N2O3
MolecularWeight
204.1821
MdlNumber
MFCD11054010
Smiles
OC(=O)c1ccc2c(c1)ncn(c2=O)C
Complexity
327
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
0.2
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CatalogNumber: AE31586
ChemicalName: 3-Methyl-4-oxo-3,4-dihydro-7-quinazolinecarboxylic acid
CasNumber: 1060817-67-5
MolecularFormula: C10H8N2O3
MolecularWeight: 204.1821
MdlNumber: MFCD11054010
Smiles: OC(=O)c1ccc2c(c1)ncn(c2=O)C
Complexity: 327
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 0.2
CatalogNumber:
AE31586
ChemicalName:
3-Methyl-4-oxo-3,4-dihydro-7-quinazolinecarboxylic acid
CasNumber:
1060817-67-5
MolecularFormula:
C10H8N2O3
MolecularWeight:
204.1821
MdlNumber:
MFCD11054010
Smiles:
OC(=O)c1ccc2c(c1)ncn(c2=O)C
Complexity:
327
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
0.2
CatalogNumber: __
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Smiles: COc1n[nH]c2c1c(nc(n2)S(=O)(=O)C)S(=O)(=O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
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Smiles:
COc1n[nH]c2c1c(nc(n2)S(=O)(=O)C)S(=O)(=O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
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RotatableBondCount:
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Smiles: O=C(N1CCC2(CC1)CCN(C2)C(C)C)OC(C)(C)C
Complexity: __
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Smiles:
O=C(N1CCC2(CC1)CCN(C2)C(C)C)OC(C)(C)C
Complexity:
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HeavyAtomCount:
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Smiles: C=CCOC(=O)N1CCC2(CC1)CCNC(=O)C2
Complexity: __
Covalently-bondedUnitCount: __
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:
C=CCOC(=O)N1CCC2(CC1)CCNC(=O)C2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__