AB54565
1187385-66-5 | (1-2-Piperidinoethyl)pyrazole
Manufacturer: A2B Chem
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CatalogNumber
AB54565
ChemicalName
(1-2-Piperidinoethyl)pyrazole
CasNumber
1187385-66-5
MolecularFormula
C10H17N3
MolecularWeight
179.2621
MdlNumber
MFCD03727253
Smiles
C1CCN(CC1)CCn1cccn1
Complexity
143
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
2
RotatableBondCount
3
Xlogp3
1
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CatalogNumber: AB54565
ChemicalName: (1-2-Piperidinoethyl)pyrazole
CasNumber: 1187385-66-5
MolecularFormula: C10H17N3
MolecularWeight: 179.2621
MdlNumber: MFCD03727253
Smiles: C1CCN(CC1)CCn1cccn1
Complexity: 143
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 2
RotatableBondCount: 3
Xlogp3: 1
CatalogNumber:
AB54565
ChemicalName:
(1-2-Piperidinoethyl)pyrazole
CasNumber:
1187385-66-5
MolecularFormula:
C10H17N3
MolecularWeight:
179.2621
MdlNumber:
MFCD03727253
Smiles:
C1CCN(CC1)CCn1cccn1
Complexity:
143
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
2
RotatableBondCount:
3
Xlogp3:
1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C1CC[C@]2(C(=CC[C@@H]3[C@@H]2CC[C@]2([C@H]3CC[C@@H]2OC(=O)c2ccccc2)C)O1)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1CC[C@]2(C(=CC[C@@H]3[C@@H]2CC[C@]2([C@H]3CC[C@@H]2OC(=O)c2ccccc2)C)O1)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)[C@@H]1CC[C@@H]([C@@H](C1)C(=O)O)C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)[C@@H]1CC[C@@H]([C@@H](C1)C(=O)O)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB54568
ChemicalName: 1-Benzyl-1H-pyrazole-4-boronic acid
CasNumber: 852362-22-2
MolecularFormula: C10H11BN2O2
MolecularWeight: 202.0175
MdlNumber: MFCD04038760
Smiles: OB(c1cnn(c1)Cc1ccccc1)O
Complexity: 198
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: __
CatalogNumber:
AB54568
ChemicalName:
1-Benzyl-1H-pyrazole-4-boronic acid
CasNumber:
852362-22-2
MolecularFormula:
C10H11BN2O2
MolecularWeight:
202.0175
MdlNumber:
MFCD04038760
Smiles:
OB(c1cnn(c1)Cc1ccccc1)O
Complexity:
198
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
__