AI95250
1251021-24-5 | 2-(tert-Butoxycarbonyl)-8-oxa-2-azaspiro[4.5]decane-4-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AI95250
ChemicalName
2-(tert-Butoxycarbonyl)-8-oxa-2-azaspiro[4.5]decane-4-carboxylic acid
CasNumber
1251021-24-5
MolecularFormula
C14H23NO5
MolecularWeight
285.33611999999994
MdlNumber
MFCD18089873
Smiles
OC(=O)C1CN(CC21CCOCC2)C(=O)OC(C)(C)C
Complexity
395
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
3
UndefinedAtomStereocenterCount
1
Xlogp3
0.9
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CatalogNumber: AI95250
ChemicalName: 2-(tert-Butoxycarbonyl)-8-oxa-2-azaspiro[4.5]decane-4-carboxylic acid
CasNumber: 1251021-24-5
MolecularFormula: C14H23NO5
MolecularWeight: 285.33611999999994
MdlNumber: MFCD18089873
Smiles: OC(=O)C1CN(CC21CCOCC2)C(=O)OC(C)(C)C
Complexity: 395
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 3
UndefinedAtomStereocenterCount: 1
Xlogp3: 0.9
CatalogNumber:
AI95250
ChemicalName:
2-(tert-Butoxycarbonyl)-8-oxa-2-azaspiro[4.5]decane-4-carboxylic acid
CasNumber:
1251021-24-5
MolecularFormula:
C14H23NO5
MolecularWeight:
285.33611999999994
MdlNumber:
MFCD18089873
Smiles:
OC(=O)C1CN(CC21CCOCC2)C(=O)OC(C)(C)C
Complexity:
395
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
1
Xlogp3:
0.9
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Smiles: O=C1CCCC2N1CC1CNCC2C1
Complexity: __
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Smiles:
O=C1CCCC2N1CC1CNCC2C1
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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__
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Smiles: O=c1[nH]nc2n1ccnc2n1cncc1
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Smiles:
O=c1[nH]nc2n1ccnc2n1cncc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
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MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)Cc1csc2n1c(=O)cc(n2)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)Cc1csc2n1c(=O)cc(n2)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__