AA42516
1273567-44-4 | (S)-4-(tert-Butoxycarbonyl)-1,4-oxazepane-2-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AA42516
ChemicalName
(S)-4-(tert-Butoxycarbonyl)-1,4-oxazepane-2-carboxylic acid
CasNumber
1273567-44-4
MolecularFormula
C11H19NO5
MolecularWeight
245.2723
MdlNumber
MFCD19442252
Smiles
OC(=O)[C@H]1OCCCN(C1)C(=O)OC(C)(C)C
Complexity
297
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
0.7
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CatalogNumber: AA42516
ChemicalName: (S)-4-(tert-Butoxycarbonyl)-1,4-oxazepane-2-carboxylic acid
CasNumber: 1273567-44-4
MolecularFormula: C11H19NO5
MolecularWeight: 245.2723
MdlNumber: MFCD19442252
Smiles: OC(=O)[C@H]1OCCCN(C1)C(=O)OC(C)(C)C
Complexity: 297
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 0.7
CatalogNumber:
AA42516
ChemicalName:
(S)-4-(tert-Butoxycarbonyl)-1,4-oxazepane-2-carboxylic acid
CasNumber:
1273567-44-4
MolecularFormula:
C11H19NO5
MolecularWeight:
245.2723
MdlNumber:
MFCD19442252
Smiles:
OC(=O)[C@H]1OCCCN(C1)C(=O)OC(C)(C)C
Complexity:
297
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
0.7
CatalogNumber: __
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Smiles: F[C@@H]1CCN(C[C@H]1N)C(=O)OC(C)(C)C
Complexity: __
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Smiles:
F[C@@H]1CCN(C[C@H]1N)C(=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: O1CC(C1)C1CCNC1
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Smiles:
O1CC(C1)C1CCNC1
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: NC1CCCC(C1)F
Complexity: __
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__
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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:
NC1CCCC(C1)F
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__