AA50009
1370411-44-1 | Benzyl 2,4-dichloro-5,6-dihydropyrido[3,4-d]pyrimidine-7(8h)-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AA50009
ChemicalName
Benzyl 2,4-dichloro-5,6-dihydropyrido[3,4-d]pyrimidine-7(8h)-carboxylate
CasNumber
1370411-44-1
MolecularFormula
C15H13Cl2N3O2
MolecularWeight
338.1886
MdlNumber
MFCD02093985
Smiles
Clc1nc2CN(CCc2c(n1)Cl)C(=O)OCc1ccccc1
Complexity
393
Covalently-bondedUnitCount
1
HeavyAtomCount
22
HydrogenBondAcceptorCount
4
RotatableBondCount
3
Xlogp3
3.4
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CatalogNumber: AA50009
ChemicalName: Benzyl 2,4-dichloro-5,6-dihydropyrido[3,4-d]pyrimidine-7(8h)-carboxylate
CasNumber: 1370411-44-1
MolecularFormula: C15H13Cl2N3O2
MolecularWeight: 338.1886
MdlNumber: MFCD02093985
Smiles: Clc1nc2CN(CCc2c(n1)Cl)C(=O)OCc1ccccc1
Complexity: 393
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
Xlogp3: 3.4
CatalogNumber:
AA50009
ChemicalName:
Benzyl 2,4-dichloro-5,6-dihydropyrido[3,4-d]pyrimidine-7(8h)-carboxylate
CasNumber:
1370411-44-1
MolecularFormula:
C15H13Cl2N3O2
MolecularWeight:
338.1886
MdlNumber:
MFCD02093985
Smiles:
Clc1nc2CN(CCc2c(n1)Cl)C(=O)OCc1ccccc1
Complexity:
393
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
Xlogp3:
3.4
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Smiles: Fc1ccc(cc1)CCS(=O)(=O)c1nnnn1c1ccccc1
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Fc1ccc(cc1)CCS(=O)(=O)c1nnnn1c1ccccc1
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Smiles: Ic1ccccc1C(=O)n1c(C)c(c2c1cccc2)C
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Ic1ccccc1C(=O)n1c(C)c(c2c1cccc2)C
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Smiles: C[C@@H](c1c(Cl)cncc1Cl)OS(=O)(=O)C
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MdlNumber:
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Smiles:
C[C@@H](c1c(Cl)cncc1Cl)OS(=O)(=O)C
Complexity:
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Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Xlogp3:
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