AB77082
3479-47-8 | Z-Asp(OBzl)-OH
Manufacturer: A2B Chem
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CatalogNumber
AB77082
ChemicalName
Z-Asp(OBzl)-OH
CasNumber
3479-47-8
MolecularFormula
C19H19NO6
MolecularWeight
357.3573
MdlNumber
MFCD00037820
Smiles
O=C(C[C@@H](C(=O)O)NC(=O)OCc1ccccc1)OCc1ccccc1
Complexity
469
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
26
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
2
RotatableBondCount
10
Xlogp3
2.4
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CatalogNumber: AB77082
ChemicalName: Z-Asp(OBzl)-OH
CasNumber: 3479-47-8
MolecularFormula: C19H19NO6
MolecularWeight: 357.3573
MdlNumber: MFCD00037820
Smiles: O=C(C[C@@H](C(=O)O)NC(=O)OCc1ccccc1)OCc1ccccc1
Complexity: 469
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 26
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 2
RotatableBondCount: 10
Xlogp3: 2.4
CatalogNumber:
AB77082
ChemicalName:
Z-Asp(OBzl)-OH
CasNumber:
3479-47-8
MolecularFormula:
C19H19NO6
MolecularWeight:
357.3573
MdlNumber:
MFCD00037820
Smiles:
O=C(C[C@@H](C(=O)O)NC(=O)OCc1ccccc1)OCc1ccccc1
Complexity:
469
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
26
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
2
RotatableBondCount:
10
Xlogp3:
2.4
CatalogNumber: AB77083
ChemicalName: Z-L-Asp(OtBu)-OMe
CasNumber: 63327-57-1
MolecularFormula: C17H23NO6
MolecularWeight: 337.3676
MdlNumber: MFCD00167022
Smiles: COC(=O)[C@H](CC(=O)OC(C)(C)C)NC(=O)OCc1ccccc1
Complexity: 437
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 24
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: 10
Xlogp3: 2.2
CatalogNumber:
AB77083
ChemicalName:
Z-L-Asp(OtBu)-OMe
CasNumber:
63327-57-1
MolecularFormula:
C17H23NO6
MolecularWeight:
337.3676
MdlNumber:
MFCD00167022
Smiles:
COC(=O)[C@H](CC(=O)OC(C)(C)C)NC(=O)OCc1ccccc1
Complexity:
437
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
24
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
10
Xlogp3:
2.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: c1ccc(cc1)CNc1ccccn1
Complexity: 152
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.7
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:
c1ccc(cc1)CNc1ccccn1
Complexity:
152
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
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MolecularWeight: __
MdlNumber: __
Smiles: C=C[C@H]1C[N+]2(CC[C@H]1C[C@@H]2[C@H](c1ccnc2c1cc(OC)cc2)O)Cc1ccccc1.[Cl-]
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C=C[C@H]1C[N+]2(CC[C@H]1C[C@@H]2[C@H](c1ccnc2c1cc(OC)cc2)O)Cc1ccccc1.[Cl-]
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__