AG20513
44520-54-9 | D-Allo-threoninol
Manufacturer: A2B Chem
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CatalogNumber
AG20513
ChemicalName
D-Allo-threoninol
CasNumber
44520-54-9
MolecularFormula
C4H11NO2
MolecularWeight
105.1356
MdlNumber
MFCD00237374
Smiles
OC[C@@H]([C@H](O)C)N
Complexity
49
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
2
HeavyAtomCount
7
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
3
RotatableBondCount
2
Xlogp3
-1.6
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CatalogNumber: AG20513
ChemicalName: D-Allo-threoninol
CasNumber: 44520-54-9
MolecularFormula: C4H11NO2
MolecularWeight: 105.1356
MdlNumber: MFCD00237374
Smiles: OC[C@@H]([C@H](O)C)N
Complexity: 49
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 2
HeavyAtomCount: 7
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 3
RotatableBondCount: 2
Xlogp3: -1.6
CatalogNumber:
AG20513
ChemicalName:
D-Allo-threoninol
CasNumber:
44520-54-9
MolecularFormula:
C4H11NO2
MolecularWeight:
105.1356
MdlNumber:
MFCD00237374
Smiles:
OC[C@@H]([C@H](O)C)N
Complexity:
49
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
2
HeavyAtomCount:
7
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
3
RotatableBondCount:
2
Xlogp3:
-1.6
CatalogNumber: AG20514
ChemicalName: Cyclo(-gly-ser)
CasNumber: 52661-98-0
MolecularFormula: C5H8N2O3
MolecularWeight: 144.1286
MdlNumber: MFCD00237615
Smiles: OC[C@@H]1NC(=O)CNC1=O
Complexity: 168
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 3
RotatableBondCount: 1
Xlogp3: -1.4
CatalogNumber:
AG20514
ChemicalName:
Cyclo(-gly-ser)
CasNumber:
52661-98-0
MolecularFormula:
C5H8N2O3
MolecularWeight:
144.1286
MdlNumber:
MFCD00237615
Smiles:
OC[C@@H]1NC(=O)CNC1=O
Complexity:
168
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
3
RotatableBondCount:
1
Xlogp3:
-1.4
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OCC(C(=O)OC)NC(=O)C
Complexity: __
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DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
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MolecularFormula:
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MolecularWeight:
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Smiles:
OCC(C(=O)OC)NC(=O)C
Complexity:
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Covalently-bondedUnitCount:
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DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NCC(=O)N[C@@H](C(=O)O)Cc1c[nH]c2c1cccc2
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NCC(=O)N[C@@H](C(=O)O)Cc1c[nH]c2c1cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__