AI16231
1251000-13-1 | 6-Oxa-9-aza-spiro[4.5]decane-2,9-dicarboxylic acid 9-tert-butyl ester
Manufacturer: A2B Chem
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CatalogNumber
AI16231
ChemicalName
6-Oxa-9-aza-spiro[4.5]decane-2,9-dicarboxylic acid 9-tert-butyl ester
CasNumber
1251000-13-1
MolecularFormula
C14H23NO5
MolecularWeight
285.3361
MdlNumber
MFCD17016263
Smiles
OC(=O)C1CCC2(C1)OCCN(C2)C(=O)OC(C)(C)C
Complexity
403
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
3
UndefinedAtomStereocenterCount
2
Xlogp3
1
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CatalogNumber: AI16231
ChemicalName: 6-Oxa-9-aza-spiro[4.5]decane-2,9-dicarboxylic acid 9-tert-butyl ester
CasNumber: 1251000-13-1
MolecularFormula: C14H23NO5
MolecularWeight: 285.3361
MdlNumber: MFCD17016263
Smiles: OC(=O)C1CCC2(C1)OCCN(C2)C(=O)OC(C)(C)C
Complexity: 403
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 3
UndefinedAtomStereocenterCount: 2
Xlogp3: 1
CatalogNumber:
AI16231
ChemicalName:
6-Oxa-9-aza-spiro[4.5]decane-2,9-dicarboxylic acid 9-tert-butyl ester
CasNumber:
1251000-13-1
MolecularFormula:
C14H23NO5
MolecularWeight:
285.3361
MdlNumber:
MFCD17016263
Smiles:
OC(=O)C1CCC2(C1)OCCN(C2)C(=O)OC(C)(C)C
Complexity:
403
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
2
Xlogp3:
1
CatalogNumber: AI16232
ChemicalName: tert-Butyl 3'-bromo-5',6'-dihydrospiro[piperidine-4,7'-pyrrolo[1,2-a]imidazole]-1-carboxylate
CasNumber: 1251000-16-4
MolecularFormula: C15H22BrN3O2
MolecularWeight: 356.2581
MdlNumber: MFCD14581089
Smiles: O=C(N1CCC2(CC1)CCn1c2ncc1Br)OC(C)(C)C
Complexity: 416
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: __
RotatableBondCount: 2
UndefinedAtomStereocenterCount: __
Xlogp3: 2.6
CatalogNumber:
AI16232
ChemicalName:
tert-Butyl 3'-bromo-5',6'-dihydrospiro[piperidine-4,7'-pyrrolo[1,2-a]imidazole]-1-carboxylate
CasNumber:
1251000-16-4
MolecularFormula:
C15H22BrN3O2
MolecularWeight:
356.2581
MdlNumber:
MFCD14581089
Smiles:
O=C(N1CCC2(CC1)CCn1c2ncc1Br)OC(C)(C)C
Complexity:
416
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
__
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
__
Xlogp3:
2.6
CatalogNumber: AI16233
ChemicalName: 5-Oxo-8-phenyl-2,6-diaza-spiro[3.4]octane-2-carboxylic acid tert-butyl ester
CasNumber: 1251000-17-5
MolecularFormula: C17H22N2O3
MolecularWeight: 302.3682
MdlNumber: MFCD17016413
Smiles: O=C(N1CC2(C1)C(=O)NCC2c1ccccc1)OC(C)(C)C
Complexity: 457
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
UndefinedAtomStereocenterCount: 1
Xlogp3: 1.5
CatalogNumber:
AI16233
ChemicalName:
5-Oxo-8-phenyl-2,6-diaza-spiro[3.4]octane-2-carboxylic acid tert-butyl ester
CasNumber:
1251000-17-5
MolecularFormula:
C17H22N2O3
MolecularWeight:
302.3682
MdlNumber:
MFCD17016413
Smiles:
O=C(N1CC2(C1)C(=O)NCC2c1ccccc1)OC(C)(C)C
Complexity:
457
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
1
Xlogp3:
1.5
CatalogNumber: AI16234
ChemicalName: tert-Butyl 3-hydroxy-6,6-dimethyl-6,7-dihydro-1H-pyrazolo[4,3-b]pyridine-4(5H)-carboxylate
CasNumber: 1251000-23-3
MolecularFormula: C13H21N3O3
MolecularWeight: 267.3241
MdlNumber: MFCD17016907
Smiles: O=C(N1CC(C)(C)Cc2c1c(O)n[nH]2)OC(C)(C)C
Complexity: 460
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 2
UndefinedAtomStereocenterCount: __
Xlogp3: 1.9
CatalogNumber:
AI16234
ChemicalName:
tert-Butyl 3-hydroxy-6,6-dimethyl-6,7-dihydro-1H-pyrazolo[4,3-b]pyridine-4(5H)-carboxylate
CasNumber:
1251000-23-3
MolecularFormula:
C13H21N3O3
MolecularWeight:
267.3241
MdlNumber:
MFCD17016907
Smiles:
O=C(N1CC(C)(C)Cc2c1c(O)n[nH]2)OC(C)(C)C
Complexity:
460
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
__
Xlogp3:
1.9