AA31942
1258283-17-8 | Ethyl 4-bromo-1,3-oxazole-5-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AA31942
ChemicalName
Ethyl 4-bromo-1,3-oxazole-5-carboxylate
CasNumber
1258283-17-8
MolecularFormula
C6H6BrNO3
MolecularWeight
220.0207
MdlNumber
MFCD20260216
Smiles
CCOC(=O)c1ocnc1Br
Complexity
153
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
4
RotatableBondCount
3
Xlogp3
1.9
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CatalogNumber: AA31942
ChemicalName: Ethyl 4-bromo-1,3-oxazole-5-carboxylate
CasNumber: 1258283-17-8
MolecularFormula: C6H6BrNO3
MolecularWeight: 220.0207
MdlNumber: MFCD20260216
Smiles: CCOC(=O)c1ocnc1Br
Complexity: 153
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
Xlogp3: 1.9
CatalogNumber:
AA31942
ChemicalName:
Ethyl 4-bromo-1,3-oxazole-5-carboxylate
CasNumber:
1258283-17-8
MolecularFormula:
C6H6BrNO3
MolecularWeight:
220.0207
MdlNumber:
MFCD20260216
Smiles:
CCOC(=O)c1ocnc1Br
Complexity:
153
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
Xlogp3:
1.9
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ChemicalName: __
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MolecularFormula: __
MolecularWeight: __
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Smiles: C[C@@H]1OC[C@@H](NC1)C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
C[C@@H]1OC[C@@H](NC1)C
Complexity:
__
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: Oc1c(ccc2c1C1(CC2)CCc2c1c(O)c(cc2)c1c(cc(cc1C(C)C)C(C)C)C(C)C)c1c(cc(cc1C(C)C)C(C)C)C(C)C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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Smiles:
Oc1c(ccc2c1C1(CC2)CCc2c1c(O)c(cc2)c1c(cc(cc1C(C)C)C(C)C)C(C)C)c1c(cc(cc1C(C)C)C(C)C)C(C)C
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
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Xlogp3:
__
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Smiles: COC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)Nc1ccc(cc1)[C@@H]1CC[C@H](N1c1ccc(cc1)C(C)(C)C)c1ccc(cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C(C)C)NC(=O)OC)C(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
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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:
COC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)Nc1ccc(cc1)[C@@H]1CC[C@H](N1c1ccc(cc1)C(C)(C)C)c1ccc(cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C(C)C)NC(=O)OC)C(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__