AG25746
438049-91-3 | (3R,5R)-tert-Butyl 3,5-dimethylpiperazine-1-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AG25746
ChemicalName
(3R,5R)-tert-Butyl 3,5-dimethylpiperazine-1-carboxylate
CasNumber
438049-91-3
MolecularFormula
C11H22N2O2
MolecularWeight
214.3046
MdlNumber
MFCD08686695
Smiles
C[C@H]1N[C@H](C)CN(C1)C(=O)OC(C)(C)C
Complexity
225
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
2
HeavyAtomCount
15
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
1.3
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CatalogNumber: AG25746
ChemicalName: (3R,5R)-tert-Butyl 3,5-dimethylpiperazine-1-carboxylate
CasNumber: 438049-91-3
MolecularFormula: C11H22N2O2
MolecularWeight: 214.3046
MdlNumber: MFCD08686695
Smiles: C[C@H]1N[C@H](C)CN(C1)C(=O)OC(C)(C)C
Complexity: 225
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 2
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.3
CatalogNumber:
AG25746
ChemicalName:
(3R,5R)-tert-Butyl 3,5-dimethylpiperazine-1-carboxylate
CasNumber:
438049-91-3
MolecularFormula:
C11H22N2O2
MolecularWeight:
214.3046
MdlNumber:
MFCD08686695
Smiles:
C[C@H]1N[C@H](C)CN(C1)C(=O)OC(C)(C)C
Complexity:
225
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
2
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.3
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Smiles: COC(=O)c1cc(N)c(c(c1)S(=O)(=O)N)Oc1ccccc1
Complexity: __
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Smiles:
COC(=O)c1cc(N)c(c(c1)S(=O)(=O)N)Oc1ccccc1
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Smiles: ClCCCCCCC(=C)Cl
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ClCCCCCCC(=C)Cl
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Smiles: CS(=O)(=O)SCCCSS(=O)(=O)C
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Smiles:
CS(=O)(=O)SCCCSS(=O)(=O)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
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