AB76865
82717-96-2 | N-[(S)-(+)-1-(Ethoxycarbonyl)-3-phenylpropyl]-l-alanine
Manufacturer: A2B Chem
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CatalogNumber
AB76865
ChemicalName
N-[(S)-(+)-1-(Ethoxycarbonyl)-3-phenylpropyl]-l-alanine
CasNumber
82717-96-2
MolecularFormula
C15H21NO4
MolecularWeight
279.3315
MdlNumber
MFCD00209976
Smiles
CCOC(=O)[C@@H](N[C@H](C(=O)O)C)CCc1ccccc1
Complexity
313
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
2
HeavyAtomCount
20
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
9
Xlogp3
0.1
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CatalogNumber: AB76865
ChemicalName: N-[(S)-(+)-1-(Ethoxycarbonyl)-3-phenylpropyl]-l-alanine
CasNumber: 82717-96-2
MolecularFormula: C15H21NO4
MolecularWeight: 279.3315
MdlNumber: MFCD00209976
Smiles: CCOC(=O)[C@@H](N[C@H](C(=O)O)C)CCc1ccccc1
Complexity: 313
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 2
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 9
Xlogp3: 0.1
CatalogNumber:
AB76865
ChemicalName:
N-[(S)-(+)-1-(Ethoxycarbonyl)-3-phenylpropyl]-l-alanine
CasNumber:
82717-96-2
MolecularFormula:
C15H21NO4
MolecularWeight:
279.3315
MdlNumber:
MFCD00209976
Smiles:
CCOC(=O)[C@@H](N[C@H](C(=O)O)C)CCc1ccccc1
Complexity:
313
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
2
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
9
Xlogp3:
0.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C[Si](CNCc1ccccc1)(C)C
Complexity: 134
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
C[Si](CNCc1ccccc1)(C)C
Complexity:
134
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OCNC(=O)N(C1C(=O)N(C(=O)N1CO)CO)CO
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OCNC(=O)N(C1C(=O)N(C(=O)N1CO)CO)CO
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OCCOCCNC(=O)c1ccc(cc1)c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OCCOCCNC(=O)c1ccc(cc1)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__