AC85749
669715-28-0 | 5-(4-Bromophenyl)-3H-1,3,4-oxadiazol-2-one
Manufacturer: A2B Chem
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CatalogNumber
AC85749
ChemicalName
5-(4-Bromophenyl)-3H-1,3,4-oxadiazol-2-one
CasNumber
669715-28-0
MolecularFormula
C8H5BrN2O2
MolecularWeight
241.0415
MdlNumber
MFCD04226282
Smiles
Brc1ccc(cc1)c1n[nH]c(=O)o1
Complexity
247
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
2.1
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CatalogNumber: AC85749
ChemicalName: 5-(4-Bromophenyl)-3H-1,3,4-oxadiazol-2-one
CasNumber: 669715-28-0
MolecularFormula: C8H5BrN2O2
MolecularWeight: 241.0415
MdlNumber: MFCD04226282
Smiles: Brc1ccc(cc1)c1n[nH]c(=O)o1
Complexity: 247
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.1
CatalogNumber:
AC85749
ChemicalName:
5-(4-Bromophenyl)-3H-1,3,4-oxadiazol-2-one
CasNumber:
669715-28-0
MolecularFormula:
C8H5BrN2O2
MolecularWeight:
241.0415
MdlNumber:
MFCD04226282
Smiles:
Brc1ccc(cc1)c1n[nH]c(=O)o1
Complexity:
247
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.1
CatalogNumber: AC85750
ChemicalName: 4-N-Boc-amino-3-methoxy-phenylboronic acid
CasNumber: 669713-95-5
MolecularFormula: C12H18BNO5
MolecularWeight: 267.086
MdlNumber: MFCD03426361
Smiles: COc1cc(ccc1NC(=O)OC(C)(C)C)B(O)O
Complexity: 305
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 3
RotatableBondCount: 5
Xlogp3: __
CatalogNumber:
AC85750
ChemicalName:
4-N-Boc-amino-3-methoxy-phenylboronic acid
CasNumber:
669713-95-5
MolecularFormula:
C12H18BNO5
MolecularWeight:
267.086
MdlNumber:
MFCD03426361
Smiles:
COc1cc(ccc1NC(=O)OC(C)(C)C)B(O)O
Complexity:
305
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
3
RotatableBondCount:
5
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CNC(c1ccc(cc1)c1ccccc1)CN1CCCC1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
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:
CNC(c1ccc(cc1)c1ccccc1)CN1CCCC1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCc1ccc(cc1)OC(C(=O)NN)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCc1ccc(cc1)OC(C(=O)NN)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__