AA79364
157355-79-8 | Fmoc-D-His-OH
Manufacturer: A2B Chem
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CatalogNumber
AA79364
ChemicalName
Fmoc-D-His-OH
CasNumber
157355-79-8
MolecularFormula
C21H19N3O4
MolecularWeight
377.3933
MdlNumber
MFCD00237022
Smiles
O=C(N[C@@H](C(=O)O)Cc1c[nH]cn1)OCC1c2ccccc2-c2c1cccc2
Complexity
550
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
28
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
3
RotatableBondCount
7
Xlogp3
2.8
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CatalogNumber: AA79364
ChemicalName: Fmoc-D-His-OH
CasNumber: 157355-79-8
MolecularFormula: C21H19N3O4
MolecularWeight: 377.3933
MdlNumber: MFCD00237022
Smiles: O=C(N[C@@H](C(=O)O)Cc1c[nH]cn1)OCC1c2ccccc2-c2c1cccc2
Complexity: 550
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 28
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 3
RotatableBondCount: 7
Xlogp3: 2.8
CatalogNumber:
AA79364
ChemicalName:
Fmoc-D-His-OH
CasNumber:
157355-79-8
MolecularFormula:
C21H19N3O4
MolecularWeight:
377.3933
MdlNumber:
MFCD00237022
Smiles:
O=C(N[C@@H](C(=O)O)Cc1c[nH]cn1)OCC1c2ccccc2-c2c1cccc2
Complexity:
550
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
28
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
3
RotatableBondCount:
7
Xlogp3:
2.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCC[C@H](c1ccc2c(c1)OCO2)NC(=O)N1C(=O)C([C@@H]1Oc1ccc(cc1)C(=O)N1CCN(CC1)C)(CC)CC
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCC[C@H](c1ccc2c(c1)OCO2)NC(=O)N1C(=O)C([C@@H]1Oc1ccc(cc1)C(=O)N1CCN(CC1)C)(CC)CC
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1c(F)c(F)c(cc1C(F)(F)F)F
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1c(F)c(F)c(cc1C(F)(F)F)F
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AA79369
ChemicalName: 2,4-Difluoro-3-(trifluoromethyl)benzoic acid
CasNumber: 157337-81-0
MolecularFormula: C8H3F5O2
MolecularWeight: 226.1002
MdlNumber: MFCD12827981
Smiles: OC(=O)c1ccc(c(c1F)C(F)(F)F)F
Complexity: 252
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 7
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.5
CatalogNumber:
AA79369
ChemicalName:
2,4-Difluoro-3-(trifluoromethyl)benzoic acid
CasNumber:
157337-81-0
MolecularFormula:
C8H3F5O2
MolecularWeight:
226.1002
MdlNumber:
MFCD12827981
Smiles:
OC(=O)c1ccc(c(c1F)C(F)(F)F)F
Complexity:
252
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
7
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.5