AI35851
1445950-77-5 | tert-Butyl 4-benzyl-1-oxa-4,8-diazaspiro[5.5]undecane-8-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AI35851
ChemicalName
tert-Butyl 4-benzyl-1-oxa-4,8-diazaspiro[5.5]undecane-8-carboxylate
CasNumber
1445950-77-5
MolecularFormula
C20H30N2O3
MolecularWeight
346.4638
MdlNumber
MFCD22384484
Smiles
O=C(N1CCCC2(C1)OCCN(C2)Cc1ccccc1)OC(C)(C)C
Complexity
456
Covalently-bondedUnitCount
1
HeavyAtomCount
25
HydrogenBondAcceptorCount
4
RotatableBondCount
4
UndefinedAtomStereocenterCount
1
Xlogp3
2.6
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CatalogNumber: AI35851
ChemicalName: tert-Butyl 4-benzyl-1-oxa-4,8-diazaspiro[5.5]undecane-8-carboxylate
CasNumber: 1445950-77-5
MolecularFormula: C20H30N2O3
MolecularWeight: 346.4638
MdlNumber: MFCD22384484
Smiles: O=C(N1CCCC2(C1)OCCN(C2)Cc1ccccc1)OC(C)(C)C
Complexity: 456
Covalently-bondedUnitCount: 1
HeavyAtomCount: 25
HydrogenBondAcceptorCount: 4
RotatableBondCount: 4
UndefinedAtomStereocenterCount: 1
Xlogp3: 2.6
CatalogNumber:
AI35851
ChemicalName:
tert-Butyl 4-benzyl-1-oxa-4,8-diazaspiro[5.5]undecane-8-carboxylate
CasNumber:
1445950-77-5
MolecularFormula:
C20H30N2O3
MolecularWeight:
346.4638
MdlNumber:
MFCD22384484
Smiles:
O=C(N1CCCC2(C1)OCCN(C2)Cc1ccccc1)OC(C)(C)C
Complexity:
456
Covalently-bondedUnitCount:
1
HeavyAtomCount:
25
HydrogenBondAcceptorCount:
4
RotatableBondCount:
4
UndefinedAtomStereocenterCount:
1
Xlogp3:
2.6
CatalogNumber: AI35852
ChemicalName: 5-(Propan-2-yl)-1,2,3-thiadiazole-4-carboxylic acid
CasNumber: 1445950-78-6
MolecularFormula: C6H8N2O2S
MolecularWeight: 172.20492000000002
MdlNumber: MFCD22390323
Smiles: CC(c1snnc1C(=O)O)C
Complexity: 163
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 5
RotatableBondCount: 2
UndefinedAtomStereocenterCount: __
Xlogp3: 1.5
CatalogNumber:
AI35852
ChemicalName:
5-(Propan-2-yl)-1,2,3-thiadiazole-4-carboxylic acid
CasNumber:
1445950-78-6
MolecularFormula:
C6H8N2O2S
MolecularWeight:
172.20492000000002
MdlNumber:
MFCD22390323
Smiles:
CC(c1snnc1C(=O)O)C
Complexity:
163
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
5
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
__
Xlogp3:
1.5
CatalogNumber: AI35853
ChemicalName: tert-Butyl 9-(hydroxymethyl)-8-oxo-2,7-diazaspiro[4.4]nonane-2-carboxylate
CasNumber: 1445950-79-7
MolecularFormula: C13H22N2O4
MolecularWeight: 270.3248
MdlNumber: MFCD25509370
Smiles: OCC1C(=O)NCC21CCN(C2)C(=O)OC(C)(C)C
Complexity: 391
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
UndefinedAtomStereocenterCount: 2
Xlogp3: 0.3
CatalogNumber:
AI35853
ChemicalName:
tert-Butyl 9-(hydroxymethyl)-8-oxo-2,7-diazaspiro[4.4]nonane-2-carboxylate
CasNumber:
1445950-79-7
MolecularFormula:
C13H22N2O4
MolecularWeight:
270.3248
MdlNumber:
MFCD25509370
Smiles:
OCC1C(=O)NCC21CCN(C2)C(=O)OC(C)(C)C
Complexity:
391
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
2
Xlogp3:
0.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1cn(c(c1)C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1cn(c(c1)C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__