AB73851
25693-43-0 | Ethyl 4-hydroxy-2-(piperidin-1-yl)pyrimidine-5-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AB73851
ChemicalName
Ethyl 4-hydroxy-2-(piperidin-1-yl)pyrimidine-5-carboxylate
CasNumber
25693-43-0
MolecularFormula
C12H17N3O3
MolecularWeight
251.2817
MdlNumber
MFCD00085757
Smiles
CCOC(=O)c1cnc(nc1O)N1CCCCC1
Complexity
409
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
4
Xlogp3
0.6
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CatalogNumber: AB73851
ChemicalName: Ethyl 4-hydroxy-2-(piperidin-1-yl)pyrimidine-5-carboxylate
CasNumber: 25693-43-0
MolecularFormula: C12H17N3O3
MolecularWeight: 251.2817
MdlNumber: MFCD00085757
Smiles: CCOC(=O)c1cnc(nc1O)N1CCCCC1
Complexity: 409
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 0.6
CatalogNumber:
AB73851
ChemicalName:
Ethyl 4-hydroxy-2-(piperidin-1-yl)pyrimidine-5-carboxylate
CasNumber:
25693-43-0
MolecularFormula:
C12H17N3O3
MolecularWeight:
251.2817
MdlNumber:
MFCD00085757
Smiles:
CCOC(=O)c1cnc(nc1O)N1CCCCC1
Complexity:
409
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
0.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)c1cnc(nc1O)C(F)(F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)c1cnc(nc1O)C(F)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB73853
ChemicalName: Ethyl 4-hydroxy-2-(methylsulfanyl)pyrimidine-5-carboxylate
CasNumber: 53554-29-3
MolecularFormula: C8H10N2O3S
MolecularWeight: 214.2416
MdlNumber: MFCD03002357
Smiles: CCOC(=O)c1cnc([nH]c1=O)SC
Complexity: 323
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 0.6
CatalogNumber:
AB73853
ChemicalName:
Ethyl 4-hydroxy-2-(methylsulfanyl)pyrimidine-5-carboxylate
CasNumber:
53554-29-3
MolecularFormula:
C8H10N2O3S
MolecularWeight:
214.2416
MdlNumber:
MFCD03002357
Smiles:
CCOC(=O)c1cnc([nH]c1=O)SC
Complexity:
323
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
0.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)c1cnc(nc1O)N1CCOCC1
Complexity: 411
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: -0.7
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)c1cnc(nc1O)N1CCOCC1
Complexity:
411
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
-0.7