AI34976
1422344-49-7 | 2-(1-(tert-Butoxycarbonyl)-3-methylazetidin-3-yl)acetic acid
Manufacturer: A2B Chem
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CatalogNumber
AI34976
ChemicalName
2-(1-(tert-Butoxycarbonyl)-3-methylazetidin-3-yl)acetic acid
CasNumber
1422344-49-7
MolecularFormula
C11H19NO4
MolecularWeight
229.2729
MdlNumber
MFCD28291973
Smiles
O=C(N1CC(C1)(C)CC(=O)O)OC(C)(C)C
Complexity
300
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
4
Xlogp3
1
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CatalogNumber: AI34976
ChemicalName: 2-(1-(tert-Butoxycarbonyl)-3-methylazetidin-3-yl)acetic acid
CasNumber: 1422344-49-7
MolecularFormula: C11H19NO4
MolecularWeight: 229.2729
MdlNumber: MFCD28291973
Smiles: O=C(N1CC(C1)(C)CC(=O)O)OC(C)(C)C
Complexity: 300
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 1
CatalogNumber:
AI34976
ChemicalName:
2-(1-(tert-Butoxycarbonyl)-3-methylazetidin-3-yl)acetic acid
CasNumber:
1422344-49-7
MolecularFormula:
C11H19NO4
MolecularWeight:
229.2729
MdlNumber:
MFCD28291973
Smiles:
O=C(N1CC(C1)(C)CC(=O)O)OC(C)(C)C
Complexity:
300
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)[C@H]1CN(C[C@@H]2[C@H]1OCCC2)C(=O)OC(C)(C)C
Complexity: 417
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 1.8
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)[C@H]1CN(C[C@@H]2[C@H]1OCCC2)C(=O)OC(C)(C)C
Complexity:
417
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
1.8
CatalogNumber: AI34978
ChemicalName: tert-Butyl (3aS,9bR)-1H,3H,3aH,4H,5H,9bH-pyrrolo[3,4-c]quinoline-2-carboxylate
CasNumber: 1422344-51-1
MolecularFormula: C16H22N2O2
MolecularWeight: 274.35808
MdlNumber: MFCD23378317
Smiles: O=C(N1C[C@H]2[C@@H](C1)c1ccccc1NC2)OC(C)(C)C
Complexity: 377
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.6
CatalogNumber:
AI34978
ChemicalName:
tert-Butyl (3aS,9bR)-1H,3H,3aH,4H,5H,9bH-pyrrolo[3,4-c]quinoline-2-carboxylate
CasNumber:
1422344-51-1
MolecularFormula:
C16H22N2O2
MolecularWeight:
274.35808
MdlNumber:
MFCD23378317
Smiles:
O=C(N1C[C@H]2[C@@H](C1)c1ccccc1NC2)OC(C)(C)C
Complexity:
377
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOC(=O)C1CNCc2n(C1)ncc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCOC(=O)C1CNCc2n(C1)ncc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__