AF59355
32137-76-1 | Ethyl 1,3-benzothiazole-2-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AF59355
ChemicalName
Ethyl 1,3-benzothiazole-2-carboxylate
CasNumber
32137-76-1
MolecularFormula
C10H9NO2S
MolecularWeight
207.249
MdlNumber
MFCD00848360
Smiles
CCOC(=O)c1nc2c(s1)cccc2
Complexity
222
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
4
RotatableBondCount
3
Xlogp3
2.9
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CatalogNumber: AF59355
ChemicalName: Ethyl 1,3-benzothiazole-2-carboxylate
CasNumber: 32137-76-1
MolecularFormula: C10H9NO2S
MolecularWeight: 207.249
MdlNumber: MFCD00848360
Smiles: CCOC(=O)c1nc2c(s1)cccc2
Complexity: 222
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
Xlogp3: 2.9
CatalogNumber:
AF59355
ChemicalName:
Ethyl 1,3-benzothiazole-2-carboxylate
CasNumber:
32137-76-1
MolecularFormula:
C10H9NO2S
MolecularWeight:
207.249
MdlNumber:
MFCD00848360
Smiles:
CCOC(=O)c1nc2c(s1)cccc2
Complexity:
222
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
Xlogp3:
2.9
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Smiles: CCOC(=O)c1[nH]c(c(c1C)C(=O)OC(C)(C)C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
CCOC(=O)c1[nH]c(c(c1C)C(=O)OC(C)(C)C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: COC(=O)[C@@H]1CNCCN1C(=O)OCc1ccccc1
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MolecularFormula:
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Smiles:
COC(=O)[C@@H]1CNCCN1C(=O)OCc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)CCc1c([nH]c(c1C(=O)OCC)C)C(=O)OCC
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)CCc1c([nH]c(c1C(=O)OCC)C)C(=O)OCC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__