AB48022
876317-19-0 | N-Boc-4-oxo-DL-Proline
Manufacturer: A2B Chem
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CatalogNumber
AB48022
ChemicalName
N-Boc-4-oxo-DL-Proline
CasNumber
876317-19-0
MolecularFormula
C10H15NO5
MolecularWeight
229.2298
MdlNumber
MFCD02668169
Smiles
O=C1CN(C(C1)C(=O)O)C(=O)OC(C)(C)C
Complexity
331
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
3
UndefinedAtomStereocenterCount
1
Xlogp3
0.3
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CatalogNumber: AB48022
ChemicalName: N-Boc-4-oxo-DL-Proline
CasNumber: 876317-19-0
MolecularFormula: C10H15NO5
MolecularWeight: 229.2298
MdlNumber: MFCD02668169
Smiles: O=C1CN(C(C1)C(=O)O)C(=O)OC(C)(C)C
Complexity: 331
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 3
UndefinedAtomStereocenterCount: 1
Xlogp3: 0.3
CatalogNumber:
AB48022
ChemicalName:
N-Boc-4-oxo-DL-Proline
CasNumber:
876317-19-0
MolecularFormula:
C10H15NO5
MolecularWeight:
229.2298
MdlNumber:
MFCD02668169
Smiles:
O=C1CN(C(C1)C(=O)O)C(=O)OC(C)(C)C
Complexity:
331
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
1
Xlogp3:
0.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: N#CNC(=NC(C(C)(C)C)NC(=O)Cc1ccc(c(c1)OC)OC)Nc1cccc2c1cccn2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
N#CNC(=NC(C(C)(C)C)NC(=O)Cc1ccc(c(c1)OC)OC)Nc1cccc2c1cccn2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: AB48024
ChemicalName: 4-Chloro-3-(N-methylcarbamoyl)phenylboronic acid
CasNumber: 871332-65-9
MolecularFormula: C8H9BClNO3
MolecularWeight: 213.426
MdlNumber: MFCD07363795
Smiles: CNC(=O)c1cc(ccc1Cl)B(O)O
Complexity: 215
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 3
RotatableBondCount: 2
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
AB48024
ChemicalName:
4-Chloro-3-(N-methylcarbamoyl)phenylboronic acid
CasNumber:
871332-65-9
MolecularFormula:
C8H9BClNO3
MolecularWeight:
213.426
MdlNumber:
MFCD07363795
Smiles:
CNC(=O)c1cc(ccc1Cl)B(O)O
Complexity:
215
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
3
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: AB48026
ChemicalName: 5-Fluoro-1H-pyrrolo[2,3-b]pyridine
CasNumber: 866319-00-8
MolecularFormula: C7H5FN2
MolecularWeight: 136.1264
MdlNumber: MFCD06659678
Smiles: Fc1cnc2c(c1)cc[nH]2
Complexity: 129
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: 1.4
CatalogNumber:
AB48026
ChemicalName:
5-Fluoro-1H-pyrrolo[2,3-b]pyridine
CasNumber:
866319-00-8
MolecularFormula:
C7H5FN2
MolecularWeight:
136.1264
MdlNumber:
MFCD06659678
Smiles:
Fc1cnc2c(c1)cc[nH]2
Complexity:
129
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
1.4