AB78770

152-43-2 | Quinestrol

Manufacturer: A2B Chem

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CatalogNumber

AB78770

ChemicalName

Quinestrol

CasNumber

152-43-2

MolecularFormula

C25H32O2

MolecularWeight

364.5204

MdlNumber

MFCD00079189

Smiles

C#C[C@]1(O)CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2CCc2c1ccc(c2)OC1CCCC1

Complexity

613

Covalently-bondedUnitCount

1

DefinedAtomStereocenterCount

5

HeavyAtomCount

27

HydrogenBondAcceptorCount

2

HydrogenBondDonorCount

1

RotatableBondCount

3

Xlogp3

5.3

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Show Difference

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A2B Chem

AB78770

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CatalogNumber:
AB78770

ChemicalName:
Quinestrol

CasNumber:
152-43-2

MolecularFormula:
C25H32O2

MolecularWeight:
364.5204

MdlNumber:
MFCD00079189

Smiles:
C#C[C@]1(O)CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2CCc2c1ccc(c2)OC1CCCC1

Complexity:
613

Covalently-bondedUnitCount:
1

DefinedAtomStereocenterCount:
5

HeavyAtomCount:
27

HydrogenBondAcceptorCount:
2

HydrogenBondDonorCount:
1

RotatableBondCount:
3

Xlogp3:
5.3

Img

A2B Chem

AB78771

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CatalogNumber:
__

ChemicalName:
__

CasNumber:
__

MolecularFormula:
__

MolecularWeight:
__

MdlNumber:
__

Smiles:
C=C[C@H]1CN2CC[C@H]1C[C@@H]2[C@H](c1ccnc2c1cc(OC)cc2)O.Cl.O

Complexity:
__

Covalently-bondedUnitCount:
__

DefinedAtomStereocenterCount:
__

HeavyAtomCount:
__

HydrogenBondAcceptorCount:
__

HydrogenBondDonorCount:
__

RotatableBondCount:
__

Xlogp3:
__

Img

A2B Chem

AB78772

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CatalogNumber:
__

ChemicalName:
__

CasNumber:
__

MolecularFormula:
__

MolecularWeight:
__

MdlNumber:
__

Smiles:
OS(=O)(=O)O.C=C[C@H]1CN2CC[C@H]1C[C@H]2[C@@H](c1ccnc2c1cc(OC)cc2)O.O.O.O.O.O.O.O

Complexity:
__

Covalently-bondedUnitCount:
__

DefinedAtomStereocenterCount:
__

HeavyAtomCount:
__

HydrogenBondAcceptorCount:
__

HydrogenBondDonorCount:
__

RotatableBondCount:
__

Xlogp3:
__

Img

A2B Chem

AB78773

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CatalogNumber:
AB78773

ChemicalName:
Quinoline-2-boronic acid

CasNumber:
745784-12-7

MolecularFormula:
C9H8BNO2

MolecularWeight:
172.9763

MdlNumber:
MFCD03095375

Smiles:
OB(c1ccc2c(n1)cccc2)O

Complexity:
177

Covalently-bondedUnitCount:
1

DefinedAtomStereocenterCount:
__

HeavyAtomCount:
13

HydrogenBondAcceptorCount:
3

HydrogenBondDonorCount:
2

RotatableBondCount:
1

Xlogp3:
__