AC70220
952480-32-9 | 2-(3-(tert-Butoxycarbonyl)-3-azaspiro[5.5]undecan-9-yl)acetic acid
Manufacturer: A2B Chem
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CatalogNumber
AC70220
ChemicalName
2-(3-(tert-Butoxycarbonyl)-3-azaspiro[5.5]undecan-9-yl)acetic acid
CasNumber
952480-32-9
MolecularFormula
C17H29NO4
MolecularWeight
311.4165
MdlNumber
MFCD12198559
Smiles
OC(=O)CC1CCC2(CC1)CCN(CC2)C(=O)OC(C)(C)C
Complexity
409
Covalently-bondedUnitCount
1
HeavyAtomCount
22
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
4
Xlogp3
3.4
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CatalogNumber: AC70220
ChemicalName: 2-(3-(tert-Butoxycarbonyl)-3-azaspiro[5.5]undecan-9-yl)acetic acid
CasNumber: 952480-32-9
MolecularFormula: C17H29NO4
MolecularWeight: 311.4165
MdlNumber: MFCD12198559
Smiles: OC(=O)CC1CCC2(CC1)CCN(CC2)C(=O)OC(C)(C)C
Complexity: 409
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 3.4
CatalogNumber:
AC70220
ChemicalName:
2-(3-(tert-Butoxycarbonyl)-3-azaspiro[5.5]undecan-9-yl)acetic acid
CasNumber:
952480-32-9
MolecularFormula:
C17H29NO4
MolecularWeight:
311.4165
MdlNumber:
MFCD12198559
Smiles:
OC(=O)CC1CCC2(CC1)CCN(CC2)C(=O)OC(C)(C)C
Complexity:
409
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
3.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(Oc1ccc(cc1)S(=O)(=O)c1ccc(cc1)O)C
Complexity: 383
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 3
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
CC(Oc1ccc(cc1)S(=O)(=O)c1ccc(cc1)O)C
Complexity:
383
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
3
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MolecularFormula: __
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Smiles: Nc1ccc(cc1)c1nc2c(s1)cc(cc2)c1nc2c(s1)cc(cc2)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
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Xlogp3: __
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MolecularFormula:
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MolecularWeight:
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Smiles:
Nc1ccc(cc1)c1nc2c(s1)cc(cc2)c1nc2c(s1)cc(cc2)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [N-]=[N+]=NS(=O)(=O)n1cncc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[N-]=[N+]=NS(=O)(=O)n1cncc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__