AI44909
21278-85-3 | Ethyl 2-(pyridin-4-yl)-1,3-thiazole-4-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AI44909
ChemicalName
Ethyl 2-(pyridin-4-yl)-1,3-thiazole-4-carboxylate
CasNumber
21278-85-3
MolecularFormula
C11H10N2O2S
MolecularWeight
234.2743
MdlNumber
MFCD00171746
Smiles
CCOC(=O)c1csc(n1)c1ccncc1
Complexity
244
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
5
RotatableBondCount
4
Xlogp3
2.1
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CatalogNumber: AI44909
ChemicalName: Ethyl 2-(pyridin-4-yl)-1,3-thiazole-4-carboxylate
CasNumber: 21278-85-3
MolecularFormula: C11H10N2O2S
MolecularWeight: 234.2743
MdlNumber: MFCD00171746
Smiles: CCOC(=O)c1csc(n1)c1ccncc1
Complexity: 244
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 5
RotatableBondCount: 4
Xlogp3: 2.1
CatalogNumber:
AI44909
ChemicalName:
Ethyl 2-(pyridin-4-yl)-1,3-thiazole-4-carboxylate
CasNumber:
21278-85-3
MolecularFormula:
C11H10N2O2S
MolecularWeight:
234.2743
MdlNumber:
MFCD00171746
Smiles:
CCOC(=O)c1csc(n1)c1ccncc1
Complexity:
244
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
5
RotatableBondCount:
4
Xlogp3:
2.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(N1CCOCC1)Nc1ccccc1C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
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:
O=C(N1CCOCC1)Nc1ccccc1C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)/C=C(C=C[C@@]1(O)C(=CC(=O)CC1(C)C)C)/C
Complexity: 494
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 1.6
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)/C=C(C=C[C@@]1(O)C(=CC(=O)CC1(C)C)C)/C
Complexity:
494
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
1.6
CatalogNumber: __
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CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C1CC(CC(=O)C1)Cl
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C1CC(CC(=O)C1)Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__