AE32021
1160246-87-6 | 2-(8-(tert-Butoxycarbonyl)-1-oxa-8-azaspiro-[4.5]decan-3-yl)acetic acid
Manufacturer: A2B Chem
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CatalogNumber
AE32021
ChemicalName
2-(8-(tert-Butoxycarbonyl)-1-oxa-8-azaspiro-[4.5]decan-3-yl)acetic acid
CasNumber
1160246-87-6
MolecularFormula
C15H25NO5
MolecularWeight
299.3627
MdlNumber
MFCD12198525
Smiles
O=C(N1CCC2(CC1)OCC(C2)CC(=O)O)OC(C)(C)C
Complexity
407
Covalently-bondedUnitCount
1
HeavyAtomCount
21
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
4
UndefinedAtomStereocenterCount
1
Xlogp3
1.2
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CatalogNumber: AE32021
ChemicalName: 2-(8-(tert-Butoxycarbonyl)-1-oxa-8-azaspiro-[4.5]decan-3-yl)acetic acid
CasNumber: 1160246-87-6
MolecularFormula: C15H25NO5
MolecularWeight: 299.3627
MdlNumber: MFCD12198525
Smiles: O=C(N1CCC2(CC1)OCC(C2)CC(=O)O)OC(C)(C)C
Complexity: 407
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 4
UndefinedAtomStereocenterCount: 1
Xlogp3: 1.2
CatalogNumber:
AE32021
ChemicalName:
2-(8-(tert-Butoxycarbonyl)-1-oxa-8-azaspiro-[4.5]decan-3-yl)acetic acid
CasNumber:
1160246-87-6
MolecularFormula:
C15H25NO5
MolecularWeight:
299.3627
MdlNumber:
MFCD12198525
Smiles:
O=C(N1CCC2(CC1)OCC(C2)CC(=O)O)OC(C)(C)C
Complexity:
407
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
4
UndefinedAtomStereocenterCount:
1
Xlogp3:
1.2
CatalogNumber: AE32022
ChemicalName: 8-(tert-Butoxycarbonyl)-1-oxa-8-azaspiro[4.5]decane-2-carboxylic acid
CasNumber: 1160246-88-7
MolecularFormula: C14H23NO5
MolecularWeight: 285.33612
MdlNumber: MFCD12198526
Smiles: OC(=O)C1CCC2(O1)CCN(CC2)C(=O)OC(C)(C)C
Complexity: 393
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 3
UndefinedAtomStereocenterCount: 1
Xlogp3: 1.5
CatalogNumber:
AE32022
ChemicalName:
8-(tert-Butoxycarbonyl)-1-oxa-8-azaspiro[4.5]decane-2-carboxylic acid
CasNumber:
1160246-88-7
MolecularFormula:
C14H23NO5
MolecularWeight:
285.33612
MdlNumber:
MFCD12198526
Smiles:
OC(=O)C1CCC2(O1)CCN(CC2)C(=O)OC(C)(C)C
Complexity:
393
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
1
Xlogp3:
1.5
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Smiles: COC(=O)C1CCC2(O1)CCN(CC2)C(=O)OC(C)(C)C
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Smiles:
COC(=O)C1CCC2(O1)CCN(CC2)C(=O)OC(C)(C)C
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Smiles: NCC1COC2(C1)CCN(CC2)C(=O)OC(C)(C)C
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Smiles:
NCC1COC2(C1)CCN(CC2)C(=O)OC(C)(C)C
Complexity:
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Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
__
UndefinedAtomStereocenterCount:
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Xlogp3:
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