AH13384
68240-63-1 | [(4-Methylphenyl)phenylmethyl]piperazine
Manufacturer: A2B Chem
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CatalogNumber
AH13384
ChemicalName
[(4-Methylphenyl)phenylmethyl]piperazine
CasNumber
68240-63-1
MolecularFormula
C18H22N2
MolecularWeight
266.3807
MdlNumber
MFCD01631964
Smiles
Cc1ccc(cc1)C(c1ccccc1)N1CCNCC1
Complexity
271
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
3
UndefinedAtomStereocenterCount
1
Xlogp3
3.2
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CatalogNumber: AH13384
ChemicalName: [(4-Methylphenyl)phenylmethyl]piperazine
CasNumber: 68240-63-1
MolecularFormula: C18H22N2
MolecularWeight: 266.3807
MdlNumber: MFCD01631964
Smiles: Cc1ccc(cc1)C(c1ccccc1)N1CCNCC1
Complexity: 271
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 3
UndefinedAtomStereocenterCount: 1
Xlogp3: 3.2
CatalogNumber:
AH13384
ChemicalName:
[(4-Methylphenyl)phenylmethyl]piperazine
CasNumber:
68240-63-1
MolecularFormula:
C18H22N2
MolecularWeight:
266.3807
MdlNumber:
MFCD01631964
Smiles:
Cc1ccc(cc1)C(c1ccccc1)N1CCNCC1
Complexity:
271
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
1
Xlogp3:
3.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C1CCC(CC1)NC1CCCCC1.OC(=O)[C@@H](NC(=O)Oc1ccccc1)CCCCNC(=O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C1CCC(CC1)NC1CCCCC1.OC(=O)[C@@H](NC(=O)Oc1ccccc1)CCCCNC(=O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: AH13386
ChemicalName: 5-(4-Bromophenyl)isoxazole
CasNumber: 7064-31-5
MolecularFormula: C9H6BrNO
MolecularWeight: 224.05404000000001
MdlNumber: MFCD02183532
Smiles: Brc1ccc(cc1)c1ccno1
Complexity: 146
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 1
UndefinedAtomStereocenterCount: __
Xlogp3: 2.7
CatalogNumber:
AH13386
ChemicalName:
5-(4-Bromophenyl)isoxazole
CasNumber:
7064-31-5
MolecularFormula:
C9H6BrNO
MolecularWeight:
224.05404000000001
MdlNumber:
MFCD02183532
Smiles:
Brc1ccc(cc1)c1ccno1
Complexity:
146
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
1
UndefinedAtomStereocenterCount:
__
Xlogp3:
2.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: ClS(=O)(=O)c1cccc(c1)c1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
ClS(=O)(=O)c1cccc(c1)c1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__