AE28617
1067718-07-3 | tert-Butyl 4-(3-nitropyridin-4-ylamino)piperidine-1-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AE28617
ChemicalName
tert-Butyl 4-(3-nitropyridin-4-ylamino)piperidine-1-carboxylate
CasNumber
1067718-07-3
MolecularFormula
C15H22N4O4
MolecularWeight
322.3596
MdlNumber
MFCD11974918
Smiles
O=C(N1CCC(CC1)Nc1ccncc1[N+](=O)[O-])OC(C)(C)C
Complexity
424
Covalently-bondedUnitCount
1
HeavyAtomCount
23
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
1
RotatableBondCount
4
Xlogp3
2.7
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CatalogNumber: AE28617
ChemicalName: tert-Butyl 4-(3-nitropyridin-4-ylamino)piperidine-1-carboxylate
CasNumber: 1067718-07-3
MolecularFormula: C15H22N4O4
MolecularWeight: 322.3596
MdlNumber: MFCD11974918
Smiles: O=C(N1CCC(CC1)Nc1ccncc1[N+](=O)[O-])OC(C)(C)C
Complexity: 424
Covalently-bondedUnitCount: 1
HeavyAtomCount: 23
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 2.7
CatalogNumber:
AE28617
ChemicalName:
tert-Butyl 4-(3-nitropyridin-4-ylamino)piperidine-1-carboxylate
CasNumber:
1067718-07-3
MolecularFormula:
C15H22N4O4
MolecularWeight:
322.3596
MdlNumber:
MFCD11974918
Smiles:
O=C(N1CCC(CC1)Nc1ccncc1[N+](=O)[O-])OC(C)(C)C
Complexity:
424
Covalently-bondedUnitCount:
1
HeavyAtomCount:
23
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
2.7
CatalogNumber: __
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MolecularFormula: __
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Smiles: COC(=O)c1ccc(c(c1)[N+](=O)[O-])NC1CCN(CC1)C(=O)OC(C)(C)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
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Smiles:
COC(=O)c1ccc(c(c1)[N+](=O)[O-])NC1CCN(CC1)C(=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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CatalogNumber: AE28619
ChemicalName: 4-Amino-1-(1-boc-azetidin-3-yl)-1H-pyrazole
CasNumber: 1029413-51-1
MolecularFormula: C11H18N4O2
MolecularWeight: 238.2862
MdlNumber: MFCD10687122
Smiles: O=C(N1CC(C1)n1ncc(c1)N)OC(C)(C)C
Complexity: 296
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 0.2
CatalogNumber:
AE28619
ChemicalName:
4-Amino-1-(1-boc-azetidin-3-yl)-1H-pyrazole
CasNumber:
1029413-51-1
MolecularFormula:
C11H18N4O2
MolecularWeight:
238.2862
MdlNumber:
MFCD10687122
Smiles:
O=C(N1CC(C1)n1ncc(c1)N)OC(C)(C)C
Complexity:
296
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
0.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(c1c(OCc2ccccc2)c(N)cc(c1C)F)Oc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(c1c(OCc2ccccc2)c(N)cc(c1C)F)Oc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__