AI32954
1373029-10-7 | Di-tert-butyl 6-methylene-1,4-diazepane-1,4-dicarboxylate
Manufacturer: A2B Chem
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CatalogNumber
AI32954
ChemicalName
Di-tert-butyl 6-methylene-1,4-diazepane-1,4-dicarboxylate
CasNumber
1373029-10-7
MolecularFormula
C16H28N2O4
MolecularWeight
312.4045
MdlNumber
MFCD23378506
Smiles
O=C(N1CCN(CC(=C)C1)C(=O)OC(C)(C)C)OC(C)(C)C
Complexity
406
Covalently-bondedUnitCount
1
HeavyAtomCount
22
HydrogenBondAcceptorCount
4
RotatableBondCount
4
Xlogp3
1.8
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CatalogNumber: AI32954
ChemicalName: Di-tert-butyl 6-methylene-1,4-diazepane-1,4-dicarboxylate
CasNumber: 1373029-10-7
MolecularFormula: C16H28N2O4
MolecularWeight: 312.4045
MdlNumber: MFCD23378506
Smiles: O=C(N1CCN(CC(=C)C1)C(=O)OC(C)(C)C)OC(C)(C)C
Complexity: 406
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 4
RotatableBondCount: 4
Xlogp3: 1.8
CatalogNumber:
AI32954
ChemicalName:
Di-tert-butyl 6-methylene-1,4-diazepane-1,4-dicarboxylate
CasNumber:
1373029-10-7
MolecularFormula:
C16H28N2O4
MolecularWeight:
312.4045
MdlNumber:
MFCD23378506
Smiles:
O=C(N1CCN(CC(=C)C1)C(=O)OC(C)(C)C)OC(C)(C)C
Complexity:
406
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
4
RotatableBondCount:
4
Xlogp3:
1.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CN1C(=O)c2c(C1=O)cc(cn2)OCc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
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Smiles:
CN1C(=O)c2c(C1=O)cc(cn2)OCc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
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__
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ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NCC1CCSC21CN(C2)C(=O)OC(C)(C)C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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Smiles:
NCC1CCSC21CN(C2)C(=O)OC(C)(C)C
Complexity:
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__
HeavyAtomCount:
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HydrogenBondAcceptorCount:
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Xlogp3:
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CatalogNumber: AI32957
ChemicalName: tert-Butyl 8-(hydroxymethyl)-5-thia-2-azaspiro[3.4]octane-2-carboxylate 5,5-dioxide
CasNumber: 1373029-18-5
MolecularFormula: C12H21NO5S
MolecularWeight: 291.3638
MdlNumber: MFCD22209757
Smiles: OCC1CCS(=O)(=O)C21CN(C2)C(=O)OC(C)(C)C
Complexity: 467
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 5
RotatableBondCount: 3
Xlogp3: -0.2
CatalogNumber:
AI32957
ChemicalName:
tert-Butyl 8-(hydroxymethyl)-5-thia-2-azaspiro[3.4]octane-2-carboxylate 5,5-dioxide
CasNumber:
1373029-18-5
MolecularFormula:
C12H21NO5S
MolecularWeight:
291.3638
MdlNumber:
MFCD22209757
Smiles:
OCC1CCS(=O)(=O)C21CN(C2)C(=O)OC(C)(C)C
Complexity:
467
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
5
RotatableBondCount:
3
Xlogp3:
-0.2