AD72441
1355248-23-5 | 3-Nitro-4'-(piperidinocarbonyl)biphenyl
Manufacturer: A2B Chem
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CatalogNumber
AD72441
ChemicalName
3-Nitro-4'-(piperidinocarbonyl)biphenyl
CasNumber
1355248-23-5
MolecularFormula
C18H18N2O3
MolecularWeight
310.3471199999999
MdlNumber
MFCD21333022
Smiles
O=C(c1ccc(cc1)c1cccc(c1)[N+](=O)[O-])N1CCCCC1
Complexity
421
Covalently-bondedUnitCount
1
HeavyAtomCount
23
HydrogenBondAcceptorCount
3
RotatableBondCount
2
Xlogp3
3.7
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CatalogNumber: AD72441
ChemicalName: 3-Nitro-4'-(piperidinocarbonyl)biphenyl
CasNumber: 1355248-23-5
MolecularFormula: C18H18N2O3
MolecularWeight: 310.3471199999999
MdlNumber: MFCD21333022
Smiles: O=C(c1ccc(cc1)c1cccc(c1)[N+](=O)[O-])N1CCCCC1
Complexity: 421
Covalently-bondedUnitCount: 1
HeavyAtomCount: 23
HydrogenBondAcceptorCount: 3
RotatableBondCount: 2
Xlogp3: 3.7
CatalogNumber:
AD72441
ChemicalName:
3-Nitro-4'-(piperidinocarbonyl)biphenyl
CasNumber:
1355248-23-5
MolecularFormula:
C18H18N2O3
MolecularWeight:
310.3471199999999
MdlNumber:
MFCD21333022
Smiles:
O=C(c1ccc(cc1)c1cccc(c1)[N+](=O)[O-])N1CCCCC1
Complexity:
421
Covalently-bondedUnitCount:
1
HeavyAtomCount:
23
HydrogenBondAcceptorCount:
3
RotatableBondCount:
2
Xlogp3:
3.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1cc(Cl)ccc1c1ccc(c(c1)Cl)C#N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1cc(Cl)ccc1c1ccc(c(c1)Cl)C#N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AD72443
ChemicalName: Ethyl 4-(3-chloro-4-cyanophenyl)benzoate
CasNumber: 1355248-20-2
MolecularFormula: C16H12ClNO2
MolecularWeight: 285.725
MdlNumber: MFCD21333006
Smiles: CCOC(=O)c1ccc(cc1)c1ccc(c(c1)Cl)C#N
Complexity: 381
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 3
RotatableBondCount: 4
Xlogp3: 4.1
CatalogNumber:
AD72443
ChemicalName:
Ethyl 4-(3-chloro-4-cyanophenyl)benzoate
CasNumber:
1355248-20-2
MolecularFormula:
C16H12ClNO2
MolecularWeight:
285.725
MdlNumber:
MFCD21333006
Smiles:
CCOC(=O)c1ccc(cc1)c1ccc(c(c1)Cl)C#N
Complexity:
381
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
3
RotatableBondCount:
4
Xlogp3:
4.1
CatalogNumber: AD72444
ChemicalName: 1-BOC-3-(4-nitrophenoxymethyl)azetidine
CasNumber: 1355248-07-5
MolecularFormula: C15H20N2O5
MolecularWeight: 308.3297
MdlNumber: MFCD21333098
Smiles: O=C(N1CC(C1)COc1ccc(cc1)[N+](=O)[O-])OC(C)(C)C
Complexity: 401
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 5
RotatableBondCount: 5
Xlogp3: 2.6
CatalogNumber:
AD72444
ChemicalName:
1-BOC-3-(4-nitrophenoxymethyl)azetidine
CasNumber:
1355248-07-5
MolecularFormula:
C15H20N2O5
MolecularWeight:
308.3297
MdlNumber:
MFCD21333098
Smiles:
O=C(N1CC(C1)COc1ccc(cc1)[N+](=O)[O-])OC(C)(C)C
Complexity:
401
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
5
RotatableBondCount:
5
Xlogp3:
2.6