AG67313
57401-76-0 | 2-Amino-pyrimidine-5-carboxylic acid ethyl ester
Manufacturer: A2B Chem
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CatalogNumber
AG67313
ChemicalName
2-Amino-pyrimidine-5-carboxylic acid ethyl ester
CasNumber
57401-76-0
MolecularFormula
C7H9N3O2
MolecularWeight
167.1653
MdlNumber
MFCD04114100
Smiles
CCOC(=O)c1cnc(nc1)N
NscNumber
165511
Complexity
155
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
0.2
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CatalogNumber: AG67313
ChemicalName: 2-Amino-pyrimidine-5-carboxylic acid ethyl ester
CasNumber: 57401-76-0
MolecularFormula: C7H9N3O2
MolecularWeight: 167.1653
MdlNumber: MFCD04114100
Smiles: CCOC(=O)c1cnc(nc1)N
NscNumber: 165511
Complexity: 155
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 0.2
CatalogNumber:
AG67313
ChemicalName:
2-Amino-pyrimidine-5-carboxylic acid ethyl ester
CasNumber:
57401-76-0
MolecularFormula:
C7H9N3O2
MolecularWeight:
167.1653
MdlNumber:
MFCD04114100
Smiles:
CCOC(=O)c1cnc(nc1)N
NscNumber:
165511
Complexity:
155
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
0.2
CatalogNumber: __
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MolecularFormula: __
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Smiles: NCc1ccc(c(c1)N)OC
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Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
NCc1ccc(c(c1)N)OC
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RotatableBondCount:
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Smiles: CSC(=N)c1ccc(cc1)Cl.I
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Smiles:
CSC(=N)c1ccc(cc1)Cl.I
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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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Smiles: Cc1c(F)c(F)c(c(c1F)F)Cl
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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:
Cc1c(F)c(F)c(c(c1F)F)Cl
NscNumber:
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Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
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Xlogp3:
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