AB00469
177966-60-8 | Fmoc-L-3-benzothienylalanine
Manufacturer: A2B Chem
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CatalogNumber
AB00469
ChemicalName
Fmoc-L-3-benzothienylalanine
CasNumber
177966-60-8
MolecularFormula
C26H21NO4S
MolecularWeight
443.5142
MdlNumber
MFCD00672562
Smiles
O=C(N[C@H](C(=O)O)Cc1csc2c1cccc2)OCC1c2ccccc2-c2c1cccc2
Complexity
665
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
32
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
7
Xlogp3
5.7
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CatalogNumber: AB00469
ChemicalName: Fmoc-L-3-benzothienylalanine
CasNumber: 177966-60-8
MolecularFormula: C26H21NO4S
MolecularWeight: 443.5142
MdlNumber: MFCD00672562
Smiles: O=C(N[C@H](C(=O)O)Cc1csc2c1cccc2)OCC1c2ccccc2-c2c1cccc2
Complexity: 665
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 32
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 7
Xlogp3: 5.7
CatalogNumber:
AB00469
ChemicalName:
Fmoc-L-3-benzothienylalanine
CasNumber:
177966-60-8
MolecularFormula:
C26H21NO4S
MolecularWeight:
443.5142
MdlNumber:
MFCD00672562
Smiles:
O=C(N[C@H](C(=O)O)Cc1csc2c1cccc2)OCC1c2ccccc2-c2c1cccc2
Complexity:
665
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
32
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
7
Xlogp3:
5.7
CatalogNumber: AB00470
ChemicalName: Fmoc-L-3,4-dichloroPhe-OH
CasNumber: 177966-59-5
MolecularFormula: C24H19Cl2NO4
MolecularWeight: 456.318
MdlNumber: MFCD00273473
Smiles: O=C(N[C@H](C(=O)O)Cc1ccc(c(c1)Cl)Cl)OCC1c2ccccc2-c2c1cccc2
Complexity: 625
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 31
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 7
Xlogp3: 5.9
CatalogNumber:
AB00470
ChemicalName:
Fmoc-L-3,4-dichloroPhe-OH
CasNumber:
177966-59-5
MolecularFormula:
C24H19Cl2NO4
MolecularWeight:
456.318
MdlNumber:
MFCD00273473
Smiles:
O=C(N[C@H](C(=O)O)Cc1ccc(c(c1)Cl)Cl)OCC1c2ccccc2-c2c1cccc2
Complexity:
625
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
31
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
7
Xlogp3:
5.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(N[C@@H](C(=O)O)Cc1ccc(c(c1)Cl)Cl)OCC1c2ccccc2-c2c1cccc2
Complexity: 625
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 5.9
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(N[C@@H](C(=O)O)Cc1ccc(c(c1)Cl)Cl)OCC1c2ccccc2-c2c1cccc2
Complexity:
625
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
5.9
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Smiles: CC(=O)OC1C(OC(=O)C)C(COC(=O)C)OC(C1N1C(=O)c2c(C1=O)cccc2)F
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
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__
Smiles:
CC(=O)OC1C(OC(=O)C)C(COC(=O)C)OC(C1N1C(=O)c2c(C1=O)cccc2)F
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__