AB04439
20320-44-9 | 2-(Piperidin-1-ylcarbonyl)benzoic acid
Manufacturer: A2B Chem
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CatalogNumber
AB04439
ChemicalName
2-(Piperidin-1-ylcarbonyl)benzoic acid
CasNumber
20320-44-9
MolecularFormula
C13H15NO3
MolecularWeight
233.2631
MdlNumber
MFCD00443957
Smiles
O=C(c1ccccc1C(=O)O)N1CCCCC1
NscNumber
175179
Complexity
297
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
1.5
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CatalogNumber: AB04439
ChemicalName: 2-(Piperidin-1-ylcarbonyl)benzoic acid
CasNumber: 20320-44-9
MolecularFormula: C13H15NO3
MolecularWeight: 233.2631
MdlNumber: MFCD00443957
Smiles: O=C(c1ccccc1C(=O)O)N1CCCCC1
NscNumber: 175179
Complexity: 297
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.5
CatalogNumber:
AB04439
ChemicalName:
2-(Piperidin-1-ylcarbonyl)benzoic acid
CasNumber:
20320-44-9
MolecularFormula:
C13H15NO3
MolecularWeight:
233.2631
MdlNumber:
MFCD00443957
Smiles:
O=C(c1ccccc1C(=O)O)N1CCCCC1
NscNumber:
175179
Complexity:
297
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.5
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Smiles: O=C(c1ccccc1C(=O)O)N1CCCC1
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
O=C(c1ccccc1C(=O)O)N1CCCC1
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Complexity:
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Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: CC(N(C(=O)c1ccccc1C(=O)O)C(C)C)C
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Complexity: __
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HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularWeight:
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Smiles:
CC(N(C(=O)c1ccccc1C(=O)O)C(C)C)C
NscNumber:
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Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(c1ccccc1C(=O)O)NC(C)(C)C
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(c1ccccc1C(=O)O)NC(C)(C)C
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__