AI07627
1092301-59-1 | Ethyl 4-methoxy-2-(methylsulfanyl)pyrimidine-5-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AI07627
ChemicalName
Ethyl 4-methoxy-2-(methylsulfanyl)pyrimidine-5-carboxylate
CasNumber
1092301-59-1
MolecularFormula
C9H12N2O3S
MolecularWeight
228.26818000000003
MdlNumber
MFCD11557194
Smiles
CCOC(=O)c1cnc(nc1OC)SC
Complexity
216
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
6
RotatableBondCount
5
Xlogp3
1.6
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CatalogNumber: AI07627
ChemicalName: Ethyl 4-methoxy-2-(methylsulfanyl)pyrimidine-5-carboxylate
CasNumber: 1092301-59-1
MolecularFormula: C9H12N2O3S
MolecularWeight: 228.26818000000003
MdlNumber: MFCD11557194
Smiles: CCOC(=O)c1cnc(nc1OC)SC
Complexity: 216
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 6
RotatableBondCount: 5
Xlogp3: 1.6
CatalogNumber:
AI07627
ChemicalName:
Ethyl 4-methoxy-2-(methylsulfanyl)pyrimidine-5-carboxylate
CasNumber:
1092301-59-1
MolecularFormula:
C9H12N2O3S
MolecularWeight:
228.26818000000003
MdlNumber:
MFCD11557194
Smiles:
CCOC(=O)c1cnc(nc1OC)SC
Complexity:
216
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
6
RotatableBondCount:
5
Xlogp3:
1.6
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ChemicalName: __
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MolecularFormula: __
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Smiles: COc1cc2c(cc1OC)C/C(=C/N(C)C)/C2=O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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__
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MolecularWeight:
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Smiles:
COc1cc2c(cc1OC)C/C(=C/N(C)C)/C2=O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Smiles: COc1cc(ccc1OC)c1cc[nH]c(=S)n1
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Smiles:
COc1cc(ccc1OC)c1cc[nH]c(=S)n1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
__
Xlogp3:
__
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Smiles: OC(=O)Cn1ccc2c1cccc2Cl
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)Cn1ccc2c1cccc2Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__