AG20843
4382-63-2 | PFK-015
Manufacturer: A2B Chem
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CatalogNumber
AG20843
ChemicalName
PFK-015
CasNumber
4382-63-2
MolecularFormula
C17H12N2O
MolecularWeight
260.29
MdlNumber
MFCD28099813
Smiles
O=C(c1ccncc1)/C=C/c1ccc2c(n1)cccc2
Complexity
360
Covalently-bondedUnitCount
1
DefinedBondStereocenterCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
3
RotatableBondCount
3
Xlogp3
2.9
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CatalogNumber: AG20843
ChemicalName: PFK-015
CasNumber: 4382-63-2
MolecularFormula: C17H12N2O
MolecularWeight: 260.29
MdlNumber: MFCD28099813
Smiles: O=C(c1ccncc1)/C=C/c1ccc2c(n1)cccc2
Complexity: 360
Covalently-bondedUnitCount: 1
DefinedBondStereocenterCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 3
RotatableBondCount: 3
Xlogp3: 2.9
CatalogNumber:
AG20843
ChemicalName:
PFK-015
CasNumber:
4382-63-2
MolecularFormula:
C17H12N2O
MolecularWeight:
260.29
MdlNumber:
MFCD28099813
Smiles:
O=C(c1ccncc1)/C=C/c1ccc2c(n1)cccc2
Complexity:
360
Covalently-bondedUnitCount:
1
DefinedBondStereocenterCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
3
RotatableBondCount:
3
Xlogp3:
2.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C1Nc2c(/C/1=C/c1[nH]c(c(c1C)C(=O)N1CCC[C@@H]1CN1CCCC1)C)cc(cc2)S(=O)(=O)Cc1c(Cl)cccc1Cl
Complexity: 1180
Covalently-bondedUnitCount: __
DefinedBondStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 5
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1Nc2c(/C/1=C/c1[nH]c(c(c1C)C(=O)N1CCC[C@@H]1CN1CCCC1)C)cc(cc2)S(=O)(=O)Cc1c(Cl)cccc1Cl
Complexity:
1180
Covalently-bondedUnitCount:
__
DefinedBondStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
5
CatalogNumber: AG20845
ChemicalName: (R)-2-Ethylpiperazine dihydrochloride
CasNumber: 438050-07-8
MolecularFormula: C6H16Cl2N2
MolecularWeight: 187.1106
MdlNumber: MFCD12756012
Smiles: CC[C@@H]1CNCCN1.Cl.Cl
Complexity: 63.5
Covalently-bondedUnitCount: 3
DefinedBondStereocenterCount: __
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 2
RotatableBondCount: 1
Xlogp3: __
CatalogNumber:
AG20845
ChemicalName:
(R)-2-Ethylpiperazine dihydrochloride
CasNumber:
438050-07-8
MolecularFormula:
C6H16Cl2N2
MolecularWeight:
187.1106
MdlNumber:
MFCD12756012
Smiles:
CC[C@@H]1CNCCN1.Cl.Cl
Complexity:
63.5
Covalently-bondedUnitCount:
3
DefinedBondStereocenterCount:
__
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
2
RotatableBondCount:
1
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: BrCCC(=O)N1CCN(CC1)C(=O)CCBr
Complexity: 227
Covalently-bondedUnitCount: __
DefinedBondStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: 0.4
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
BrCCC(=O)N1CCN(CC1)C(=O)CCBr
Complexity:
227
Covalently-bondedUnitCount:
__
DefinedBondStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
0.4