AB71399
331763-56-5 | Boc-(r)-3-amino-4-(3-chloro-phenyl)-butyric acid
Manufacturer: A2B Chem
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CatalogNumber
AB71399
ChemicalName
Boc-(r)-3-amino-4-(3-chloro-phenyl)-butyric acid
CasNumber
331763-56-5
MolecularFormula
C15H20ClNO4
MolecularWeight
313.7766
MdlNumber
MFCD01860901
Smiles
OC(=O)C[C@@H](Cc1cccc(c1)Cl)NC(=O)OC(C)(C)C
Complexity
367
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
21
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
7
Xlogp3
3.1
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CatalogNumber: AB71399
ChemicalName: Boc-(r)-3-amino-4-(3-chloro-phenyl)-butyric acid
CasNumber: 331763-56-5
MolecularFormula: C15H20ClNO4
MolecularWeight: 313.7766
MdlNumber: MFCD01860901
Smiles: OC(=O)C[C@@H](Cc1cccc(c1)Cl)NC(=O)OC(C)(C)C
Complexity: 367
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 7
Xlogp3: 3.1
CatalogNumber:
AB71399
ChemicalName:
Boc-(r)-3-amino-4-(3-chloro-phenyl)-butyric acid
CasNumber:
331763-56-5
MolecularFormula:
C15H20ClNO4
MolecularWeight:
313.7766
MdlNumber:
MFCD01860901
Smiles:
OC(=O)C[C@@H](Cc1cccc(c1)Cl)NC(=O)OC(C)(C)C
Complexity:
367
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
7
Xlogp3:
3.1
CatalogNumber: AB71400
ChemicalName: (R)-3-((tert-Butoxycarbonyl)amino)-4-(3-(trifluoromethyl)phenyl)butanoic acid
CasNumber: 269726-74-1
MolecularFormula: C16H20F3NO4
MolecularWeight: 347.3295
MdlNumber: MFCD01860969
Smiles: OC(=O)C[C@@H](Cc1cccc(c1)C(F)(F)F)NC(=O)OC(C)(C)C
Complexity: 446
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 24
HydrogenBondAcceptorCount: 7
HydrogenBondDonorCount: 2
RotatableBondCount: 7
Xlogp3: 3.3
CatalogNumber:
AB71400
ChemicalName:
(R)-3-((tert-Butoxycarbonyl)amino)-4-(3-(trifluoromethyl)phenyl)butanoic acid
CasNumber:
269726-74-1
MolecularFormula:
C16H20F3NO4
MolecularWeight:
347.3295
MdlNumber:
MFCD01860969
Smiles:
OC(=O)C[C@@H](Cc1cccc(c1)C(F)(F)F)NC(=O)OC(C)(C)C
Complexity:
446
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
24
HydrogenBondAcceptorCount:
7
HydrogenBondDonorCount:
2
RotatableBondCount:
7
Xlogp3:
3.3
CatalogNumber: __
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Smiles: OC(=O)C[C@@H](Cc1ccncc1)NC(=O)OC(C)(C)C
Complexity: __
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HydrogenBondAcceptorCount: __
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Xlogp3: __
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MdlNumber:
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Smiles:
OC(=O)C[C@@H](Cc1ccncc1)NC(=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
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: O=C(OC(C)(C)C)N[C@H](c1cscc1)C(=O)O
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DefinedAtomStereocenterCount: __
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HydrogenBondAcceptorCount: __
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RotatableBondCount: __
Xlogp3: __
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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:
O=C(OC(C)(C)C)N[C@H](c1cscc1)C(=O)O
Complexity:
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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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