AI35856
1445950-84-4 | 2-tert-Butyl 5-methyl 7-oxa-2-azaspiro[3.5]nonane-2,5-dicarboxylate
Manufacturer: A2B Chem
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CatalogNumber
AI35856
ChemicalName
2-tert-Butyl 5-methyl 7-oxa-2-azaspiro[3.5]nonane-2,5-dicarboxylate
CasNumber
1445950-84-4
MolecularFormula
C14H23NO5
MolecularWeight
285.3361
MdlNumber
MFCD25509378
Smiles
COC(=O)C1COCCC21CN(C2)C(=O)OC(C)(C)C
Complexity
395
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
5
RotatableBondCount
4
UndefinedAtomStereocenterCount
1
Xlogp3
0.8
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CatalogNumber: AI35856
ChemicalName: 2-tert-Butyl 5-methyl 7-oxa-2-azaspiro[3.5]nonane-2,5-dicarboxylate
CasNumber: 1445950-84-4
MolecularFormula: C14H23NO5
MolecularWeight: 285.3361
MdlNumber: MFCD25509378
Smiles: COC(=O)C1COCCC21CN(C2)C(=O)OC(C)(C)C
Complexity: 395
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 5
RotatableBondCount: 4
UndefinedAtomStereocenterCount: 1
Xlogp3: 0.8
CatalogNumber:
AI35856
ChemicalName:
2-tert-Butyl 5-methyl 7-oxa-2-azaspiro[3.5]nonane-2,5-dicarboxylate
CasNumber:
1445950-84-4
MolecularFormula:
C14H23NO5
MolecularWeight:
285.3361
MdlNumber:
MFCD25509378
Smiles:
COC(=O)C1COCCC21CN(C2)C(=O)OC(C)(C)C
Complexity:
395
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
5
RotatableBondCount:
4
UndefinedAtomStereocenterCount:
1
Xlogp3:
0.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc(cc1)C[C@H]1CN(CC[C@H]1O)C(=O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc(cc1)C[C@H]1CN(CC[C@H]1O)C(=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: AI35858
ChemicalName: Cis-Benzyl 5-Oxohexahydropyrrolo[3,2-B]Pyrrole-1(2H)-Carboxylate
CasNumber: 1445950-86-6
MolecularFormula: C14H16N2O3
MolecularWeight: 260.2884400000001
MdlNumber: MFCD25509390
Smiles: O=C1N[C@H]2[C@@H](C1)N(CC2)C(=O)OCc1ccccc1
Complexity: 366
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
UndefinedAtomStereocenterCount: __
Xlogp3: 0.9
CatalogNumber:
AI35858
ChemicalName:
Cis-Benzyl 5-Oxohexahydropyrrolo[3,2-B]Pyrrole-1(2H)-Carboxylate
CasNumber:
1445950-86-6
MolecularFormula:
C14H16N2O3
MolecularWeight:
260.2884400000001
MdlNumber:
MFCD25509390
Smiles:
O=C1N[C@H]2[C@@H](C1)N(CC2)C(=O)OCc1ccccc1
Complexity:
366
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
__
Xlogp3:
0.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)C1CN(CC2(C1=O)CCN(CC2)Cc1ccccc1)C(=O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)C1CN(CC2(C1=O)CCN(CC2)Cc1ccccc1)C(=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__