AI41284
1823835-45-5 | 2-(((9H-Fluoren-9-yl)methoxy)carbonyl)-8-thia-2-azaspiro[4.5]decane-4-carboxylic acid 8,8-dioxide
Manufacturer: A2B Chem
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CatalogNumber
AI41284
ChemicalName
2-(((9H-Fluoren-9-yl)methoxy)carbonyl)-8-thia-2-azaspiro[4.5]decane-4-carboxylic acid 8,8-dioxide
CasNumber
1823835-45-5
MolecularFormula
C24H25NO6S
MolecularWeight
455.5234
MdlNumber
MFCD00043140
Smiles
OC(=O)C1CN(CC21CCS(=O)(=O)CC2)C(=O)OCC1c2ccccc2-c2c1cccc2
Complexity
815
Covalently-bondedUnitCount
1
HeavyAtomCount
32
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
1
RotatableBondCount
4
UndefinedAtomStereocenterCount
1
Xlogp3
2.5
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CatalogNumber: AI41284
ChemicalName: 2-(((9H-Fluoren-9-yl)methoxy)carbonyl)-8-thia-2-azaspiro[4.5]decane-4-carboxylic acid 8,8-dioxide
CasNumber: 1823835-45-5
MolecularFormula: C24H25NO6S
MolecularWeight: 455.5234
MdlNumber: MFCD00043140
Smiles: OC(=O)C1CN(CC21CCS(=O)(=O)CC2)C(=O)OCC1c2ccccc2-c2c1cccc2
Complexity: 815
Covalently-bondedUnitCount: 1
HeavyAtomCount: 32
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: 4
UndefinedAtomStereocenterCount: 1
Xlogp3: 2.5
CatalogNumber:
AI41284
ChemicalName:
2-(((9H-Fluoren-9-yl)methoxy)carbonyl)-8-thia-2-azaspiro[4.5]decane-4-carboxylic acid 8,8-dioxide
CasNumber:
1823835-45-5
MolecularFormula:
C24H25NO6S
MolecularWeight:
455.5234
MdlNumber:
MFCD00043140
Smiles:
OC(=O)C1CN(CC21CCS(=O)(=O)CC2)C(=O)OCC1c2ccccc2-c2c1cccc2
Complexity:
815
Covalently-bondedUnitCount:
1
HeavyAtomCount:
32
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
4
UndefinedAtomStereocenterCount:
1
Xlogp3:
2.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(OCc1ccccc1)NCC1CCCCNC1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(OCc1ccccc1)NCC1CCCCNC1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: AI41288
ChemicalName: Benzyl 3-(hydroxymethyl)-5-methylpiperidine-1-carboxylate
CasNumber: 1823835-83-1
MolecularFormula: C15H21NO3
MolecularWeight: 263.33214000000004
MdlNumber: MFCD28119186
Smiles: OCC1CC(C)CN(C1)C(=O)OCc1ccccc1
Complexity: 289
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 4
UndefinedAtomStereocenterCount: 2
Xlogp3: 2.1
CatalogNumber:
AI41288
ChemicalName:
Benzyl 3-(hydroxymethyl)-5-methylpiperidine-1-carboxylate
CasNumber:
1823835-83-1
MolecularFormula:
C15H21NO3
MolecularWeight:
263.33214000000004
MdlNumber:
MFCD28119186
Smiles:
OCC1CC(C)CN(C1)C(=O)OCc1ccccc1
Complexity:
289
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
4
UndefinedAtomStereocenterCount:
2
Xlogp3:
2.1
CatalogNumber: AI41289
ChemicalName: 5-tert-Butyl 7-ethyl 6,7-dihydropyrazolo[1,5-a]pyrazine-5,7(4h)-dicarboxylate
CasNumber: 1823856-54-7
MolecularFormula: C14H21N3O4
MolecularWeight: 295.3342
MdlNumber: MFCD28119022
Smiles: CCOC(=O)C1CN(Cc2n1ncc2)C(=O)OC(C)(C)C
Complexity: 408
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: __
RotatableBondCount: 5
UndefinedAtomStereocenterCount: 1
Xlogp3: 1.1
CatalogNumber:
AI41289
ChemicalName:
5-tert-Butyl 7-ethyl 6,7-dihydropyrazolo[1,5-a]pyrazine-5,7(4h)-dicarboxylate
CasNumber:
1823856-54-7
MolecularFormula:
C14H21N3O4
MolecularWeight:
295.3342
MdlNumber:
MFCD28119022
Smiles:
CCOC(=O)C1CN(Cc2n1ncc2)C(=O)OC(C)(C)C
Complexity:
408
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
__
RotatableBondCount:
5
UndefinedAtomStereocenterCount:
1
Xlogp3:
1.1