AE61928
1352318-26-3 | 4-(BOC-Amino)-1-butanoylpiperidine
Manufacturer: A2B Chem
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CatalogNumber
AE61928
ChemicalName
4-(BOC-Amino)-1-butanoylpiperidine
CasNumber
1352318-26-3
MolecularFormula
C14H26N2O3
MolecularWeight
270.3678
MdlNumber
MFCD20529528
Smiles
CCCC(=O)N1CCC(CC1)NC(=O)OC(C)(C)C
Complexity
315
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
5
Xlogp3
1.8
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CatalogNumber: AE61928
ChemicalName: 4-(BOC-Amino)-1-butanoylpiperidine
CasNumber: 1352318-26-3
MolecularFormula: C14H26N2O3
MolecularWeight: 270.3678
MdlNumber: MFCD20529528
Smiles: CCCC(=O)N1CCC(CC1)NC(=O)OC(C)(C)C
Complexity: 315
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 5
Xlogp3: 1.8
CatalogNumber:
AE61928
ChemicalName:
4-(BOC-Amino)-1-butanoylpiperidine
CasNumber:
1352318-26-3
MolecularFormula:
C14H26N2O3
MolecularWeight:
270.3678
MdlNumber:
MFCD20529528
Smiles:
CCCC(=O)N1CCC(CC1)NC(=O)OC(C)(C)C
Complexity:
315
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
5
Xlogp3:
1.8
CatalogNumber: AE61929
ChemicalName: 2-(3-Fluorophenyl)benzonitrile
CasNumber: 1352318-38-7
MolecularFormula: C13H8FN
MolecularWeight: 197.2077
MdlNumber: MFCD05980284
Smiles: N#Cc1ccccc1c1cccc(c1)F
Complexity: 255
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: 3.6
CatalogNumber:
AE61929
ChemicalName:
2-(3-Fluorophenyl)benzonitrile
CasNumber:
1352318-38-7
MolecularFormula:
C13H8FN
MolecularWeight:
197.2077
MdlNumber:
MFCD05980284
Smiles:
N#Cc1ccccc1c1cccc(c1)F
Complexity:
255
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
3.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Clc1ccc(c(n1)C)c1ccc(cc1)C(=O)O
Complexity: 277
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 3.4
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Clc1ccc(c(n1)C)c1ccc(cc1)C(=O)O
Complexity:
277
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
3.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [O-][N+](=O)c1cccc(c1)c1ccc(c(c1)C)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[O-][N+](=O)c1cccc(c1)c1ccc(c(c1)C)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__