AE63029
1217841-04-7 | (S)-tert-Butyl 2-(methylcarbamoyl)piperazine-1-carboxylate hydrochloride
Manufacturer: A2B Chem
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CatalogNumber
AE63029
ChemicalName
(S)-tert-Butyl 2-(methylcarbamoyl)piperazine-1-carboxylate hydrochloride
CasNumber
1217841-04-7
MolecularFormula
C11H22ClN3O3
MolecularWeight
279.7637
MdlNumber
MFCD11112291
Smiles
CNC(=O)[C@@H]1CNCCN1C(=O)OC(C)(C)C.Cl
Complexity
299
Covalently-bondedUnitCount
2
DefinedAtomStereocenterCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
3
RotatableBondCount
3
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CatalogNumber: AE63029
ChemicalName: (S)-tert-Butyl 2-(methylcarbamoyl)piperazine-1-carboxylate hydrochloride
CasNumber: 1217841-04-7
MolecularFormula: C11H22ClN3O3
MolecularWeight: 279.7637
MdlNumber: MFCD11112291
Smiles: CNC(=O)[C@@H]1CNCCN1C(=O)OC(C)(C)C.Cl
Complexity: 299
Covalently-bondedUnitCount: 2
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 3
RotatableBondCount: 3
CatalogNumber:
AE63029
ChemicalName:
(S)-tert-Butyl 2-(methylcarbamoyl)piperazine-1-carboxylate hydrochloride
CasNumber:
1217841-04-7
MolecularFormula:
C11H22ClN3O3
MolecularWeight:
279.7637
MdlNumber:
MFCD11112291
Smiles:
CNC(=O)[C@@H]1CNCCN1C(=O)OC(C)(C)C.Cl
Complexity:
299
Covalently-bondedUnitCount:
2
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
3
RotatableBondCount:
3
CatalogNumber: __
ChemicalName: __
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MolecularFormula: __
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Smiles: O=C([C@@H]1CNCCN1C(=O)OC(C)(C)C)N(C)C.Cl
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
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MdlNumber:
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Smiles:
O=C([C@@H]1CNCCN1C(=O)OC(C)(C)C)N(C)C.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
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HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(=O)C1NCCCN(C1)C(=O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
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RotatableBondCount: __
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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Smiles:
COC(=O)C1NCCCN(C1)C(=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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CatalogNumber: __
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Smiles: OCC(c1ccc(c(c1)C(F)(F)F)F)N.Cl
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OCC(c1ccc(c(c1)C(F)(F)F)F)N.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__