AI38014
1625680-27-4 | tert-Butyl 4-(3-(4-nitro-1h-pyrazol-1-yl)propyl)piperidine-1-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AI38014
ChemicalName
tert-Butyl 4-(3-(4-nitro-1h-pyrazol-1-yl)propyl)piperidine-1-carboxylate
CasNumber
1625680-27-4
MolecularFormula
C16H26N4O4
MolecularWeight
338.40203999999994
MdlNumber
MFCD29920227
Smiles
O=C(N1CCC(CC1)CCCn1ncc(c1)[N+](=O)[O-])OC(C)(C)C
Complexity
438
Covalently-bondedUnitCount
1
HeavyAtomCount
24
HydrogenBondAcceptorCount
5
RotatableBondCount
6
Xlogp3
2.3
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CatalogNumber: AI38014
ChemicalName: tert-Butyl 4-(3-(4-nitro-1h-pyrazol-1-yl)propyl)piperidine-1-carboxylate
CasNumber: 1625680-27-4
MolecularFormula: C16H26N4O4
MolecularWeight: 338.40203999999994
MdlNumber: MFCD29920227
Smiles: O=C(N1CCC(CC1)CCCn1ncc(c1)[N+](=O)[O-])OC(C)(C)C
Complexity: 438
Covalently-bondedUnitCount: 1
HeavyAtomCount: 24
HydrogenBondAcceptorCount: 5
RotatableBondCount: 6
Xlogp3: 2.3
CatalogNumber:
AI38014
ChemicalName:
tert-Butyl 4-(3-(4-nitro-1h-pyrazol-1-yl)propyl)piperidine-1-carboxylate
CasNumber:
1625680-27-4
MolecularFormula:
C16H26N4O4
MolecularWeight:
338.40203999999994
MdlNumber:
MFCD29920227
Smiles:
O=C(N1CCC(CC1)CCCn1ncc(c1)[N+](=O)[O-])OC(C)(C)C
Complexity:
438
Covalently-bondedUnitCount:
1
HeavyAtomCount:
24
HydrogenBondAcceptorCount:
5
RotatableBondCount:
6
Xlogp3:
2.3
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Smiles: OS(=O)(=O)O.Nc1n[nH]cc1N
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OS(=O)(=O)O.Nc1n[nH]cc1N
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Smiles: c1ccc(cc1)CC[Sn](CCc1ccccc1)(CCc1ccccc1)CCc1ccccc1
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c1ccc(cc1)CC[Sn](CCc1ccccc1)(CCc1ccccc1)CCc1ccccc1
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Smiles: CCc1ccc(o1)B(O)O
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Smiles:
CCc1ccc(o1)B(O)O
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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