AB45652
269726-86-5 | (R)-3-((tert-Butoxycarbonyl)amino)-4-(4-cyanophenyl)butanoic acid
Manufacturer: A2B Chem
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CatalogNumber
AB45652
ChemicalName
(R)-3-((tert-Butoxycarbonyl)amino)-4-(4-cyanophenyl)butanoic acid
CasNumber
269726-86-5
MolecularFormula
C16H20N2O4
MolecularWeight
304.341
MdlNumber
MFCD01860981
Smiles
N#Cc1ccc(cc1)C[C@@H](NC(=O)OC(C)(C)C)CC(=O)O
Complexity
439
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
22
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
7
Xlogp3
2.2
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CatalogNumber: AB45652
ChemicalName: (R)-3-((tert-Butoxycarbonyl)amino)-4-(4-cyanophenyl)butanoic acid
CasNumber: 269726-86-5
MolecularFormula: C16H20N2O4
MolecularWeight: 304.341
MdlNumber: MFCD01860981
Smiles: N#Cc1ccc(cc1)C[C@@H](NC(=O)OC(C)(C)C)CC(=O)O
Complexity: 439
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 7
Xlogp3: 2.2
CatalogNumber:
AB45652
ChemicalName:
(R)-3-((tert-Butoxycarbonyl)amino)-4-(4-cyanophenyl)butanoic acid
CasNumber:
269726-86-5
MolecularFormula:
C16H20N2O4
MolecularWeight:
304.341
MdlNumber:
MFCD01860981
Smiles:
N#Cc1ccc(cc1)C[C@@H](NC(=O)OC(C)(C)C)CC(=O)O
Complexity:
439
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
7
Xlogp3:
2.2
CatalogNumber: AB45653
ChemicalName: Boc-(r)-3-amino-5-phenylpentanoic acid
CasNumber: 218608-83-4
MolecularFormula: C16H23NO4
MolecularWeight: 293.3581
MdlNumber: MFCD01076262
Smiles: OC(=O)C[C@H](NC(=O)OC(C)(C)C)CCc1ccccc1
Complexity: 343
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 8
Xlogp3: 2.8
CatalogNumber:
AB45653
ChemicalName:
Boc-(r)-3-amino-5-phenylpentanoic acid
CasNumber:
218608-83-4
MolecularFormula:
C16H23NO4
MolecularWeight:
293.3581
MdlNumber:
MFCD01076262
Smiles:
OC(=O)C[C@H](NC(=O)OC(C)(C)C)CCc1ccccc1
Complexity:
343
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
8
Xlogp3:
2.8
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Smiles: N#Cc1ccccc1C[C@H](NC(=O)OC(C)(C)C)CC(=O)O
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Smiles:
N#Cc1ccccc1C[C@H](NC(=O)OC(C)(C)C)CC(=O)O
Complexity:
__
Covalently-bondedUnitCount:
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DefinedAtomStereocenterCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: OC(=O)C[C@H](Cc1ccccc1C(F)(F)F)NC(=O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)C[C@H](Cc1ccccc1C(F)(F)F)NC(=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__