AA76105
150828-96-9 | Boc-Orn(Fmoc)-OH
Manufacturer: A2B Chem
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CatalogNumber
AA76105
ChemicalName
Boc-Orn(Fmoc)-OH
CasNumber
150828-96-9
MolecularFormula
C25H30N2O6
MolecularWeight
454.5155
MdlNumber
MFCD00080279
Smiles
O=C(OCC1c2ccccc2-c2c1cccc2)NCCC[C@@H](C(=O)O)NC(=O)OC(C)(C)C
Complexity
669
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
33
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
3
RotatableBondCount
11
Xlogp3
4.1
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CatalogNumber: AA76105
ChemicalName: Boc-Orn(Fmoc)-OH
CasNumber: 150828-96-9
MolecularFormula: C25H30N2O6
MolecularWeight: 454.5155
MdlNumber: MFCD00080279
Smiles: O=C(OCC1c2ccccc2-c2c1cccc2)NCCC[C@@H](C(=O)O)NC(=O)OC(C)(C)C
Complexity: 669
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 33
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 3
RotatableBondCount: 11
Xlogp3: 4.1
CatalogNumber:
AA76105
ChemicalName:
Boc-Orn(Fmoc)-OH
CasNumber:
150828-96-9
MolecularFormula:
C25H30N2O6
MolecularWeight:
454.5155
MdlNumber:
MFCD00080279
Smiles:
O=C(OCC1c2ccccc2-c2c1cccc2)NCCC[C@@H](C(=O)O)NC(=O)OC(C)(C)C
Complexity:
669
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
33
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
3
RotatableBondCount:
11
Xlogp3:
4.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [O-]S(=O)(=O)[O-].OP(=O)(O)O.[Al+3].[OH-]
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
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-]S(=O)(=O)[O-].OP(=O)(O)O.[Al+3].[OH-]
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCN(/C(=C/N(=O)=O)/NC)Cc1ccc(nc1)Cl
Complexity: 306
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.4
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCN(/C(=C/N(=O)=O)/NC)Cc1ccc(nc1)Cl
Complexity:
306
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(c1ccc(cc1)OCCCCc1ccccc1)Nc1cccc2c1oc(cc2=O)c1nn[nH]n1.O=C(c1ccc(cc1)OCCCCc1ccccc1)Nc1cccc2c1oc(cc2=O)c1nn[nH]n1.O
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(c1ccc(cc1)OCCCCc1ccccc1)Nc1cccc2c1oc(cc2=O)c1nn[nH]n1.O=C(c1ccc(cc1)OCCCCc1ccccc1)Nc1cccc2c1oc(cc2=O)c1nn[nH]n1.O
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__