AB69696
871727-05-8 | 6-(tert-Butoxycarbonyl)-6-azaspiro[2.5]octane-1-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AB69696
ChemicalName
6-(tert-Butoxycarbonyl)-6-azaspiro[2.5]octane-1-carboxylic acid
CasNumber
871727-05-8
MolecularFormula
C13H21NO4
MolecularWeight
255.31014
MdlNumber
MFCD11007805
Smiles
O=C(N1CCC2(CC1)CC2C(=O)O)OC(C)(C)C
Complexity
364
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
3
UndefinedAtomStereocenterCount
1
Xlogp3
1.4
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CatalogNumber: AB69696
ChemicalName: 6-(tert-Butoxycarbonyl)-6-azaspiro[2.5]octane-1-carboxylic acid
CasNumber: 871727-05-8
MolecularFormula: C13H21NO4
MolecularWeight: 255.31014
MdlNumber: MFCD11007805
Smiles: O=C(N1CCC2(CC1)CC2C(=O)O)OC(C)(C)C
Complexity: 364
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
UndefinedAtomStereocenterCount: 1
Xlogp3: 1.4
CatalogNumber:
AB69696
ChemicalName:
6-(tert-Butoxycarbonyl)-6-azaspiro[2.5]octane-1-carboxylic acid
CasNumber:
871727-05-8
MolecularFormula:
C13H21NO4
MolecularWeight:
255.31014
MdlNumber:
MFCD11007805
Smiles:
O=C(N1CCC2(CC1)CC2C(=O)O)OC(C)(C)C
Complexity:
364
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
1
Xlogp3:
1.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(N1CC2C(C1)CCCN2)OC(C)(C)C
Complexity: 273
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: 1.3
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(N1CC2C(C1)CCCN2)OC(C)(C)C
Complexity:
273
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
1.3
CatalogNumber: AB69698
ChemicalName: 6-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CasNumber: 947248-68-2
MolecularFormula: C6H5BrN4
MolecularWeight: 213.0347
MdlNumber: MFCD11656619
Smiles: Brc1ccc2n(c1)nc(n2)N
Complexity: 154
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: 1.1
CatalogNumber:
AB69698
ChemicalName:
6-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CasNumber:
947248-68-2
MolecularFormula:
C6H5BrN4
MolecularWeight:
213.0347
MdlNumber:
MFCD11656619
Smiles:
Brc1ccc2n(c1)nc(n2)N
Complexity:
154
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
1.1
CatalogNumber: AB69699
ChemicalName: 6-Bromo-1,8-naphthyridin-2-ol
CasNumber: 72754-05-3
MolecularFormula: C8H5BrN2O
MolecularWeight: 225.0421
MdlNumber: MFCD09817650
Smiles: Brc1cnc2c(c1)ccc(n2)O
Complexity: 229
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: 1.3
CatalogNumber:
AB69699
ChemicalName:
6-Bromo-1,8-naphthyridin-2-ol
CasNumber:
72754-05-3
MolecularFormula:
C8H5BrN2O
MolecularWeight:
225.0421
MdlNumber:
MFCD09817650
Smiles:
Brc1cnc2c(c1)ccc(n2)O
Complexity:
229
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
1.3