AA31569

1257095-63-8 | N-(4-Methyl-3-nitrophenyl)-4-(trifluoromethyl)benzothioamide

Manufacturer: A2B Chem

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CatalogNumber

AA31569

ChemicalName

N-(4-Methyl-3-nitrophenyl)-4-(trifluoromethyl)benzothioamide

CasNumber

1257095-63-8

MolecularFormula

C15H11F3N2O2S

MolecularWeight

340.3202

MdlNumber

MFCD27952654

Smiles

S=C(c1ccc(cc1)C(F)(F)F)Nc1ccc(c(c1)[N+](=O)[O-])C

Complexity

445

Covalently-bondedUnitCount

1

HeavyAtomCount

23

HydrogenBondAcceptorCount

6

HydrogenBondDonorCount

1

RotatableBondCount

2

Xlogp3

4.4

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A2B Chem

AA31569

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CatalogNumber:
AA31569

ChemicalName:
N-(4-Methyl-3-nitrophenyl)-4-(trifluoromethyl)benzothioamide

CasNumber:
1257095-63-8

MolecularFormula:
C15H11F3N2O2S

MolecularWeight:
340.3202

MdlNumber:
MFCD27952654

Smiles:
S=C(c1ccc(cc1)C(F)(F)F)Nc1ccc(c(c1)[N+](=O)[O-])C

Complexity:
445

Covalently-bondedUnitCount:
1

HeavyAtomCount:
23

HydrogenBondAcceptorCount:
6

HydrogenBondDonorCount:
1

RotatableBondCount:
2

Xlogp3:
4.4

Img

A2B Chem

AA31570

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CatalogNumber:
__

ChemicalName:
__

CasNumber:
__

MolecularFormula:
__

MolecularWeight:
__

MdlNumber:
__

Smiles:
S=C(c1ccc(cc1)C(F)(F)F)Nc1ccc(c(c1)[N+](=O)[O-])Cl

Complexity:
__

Covalently-bondedUnitCount:
__

HeavyAtomCount:
__

HydrogenBondAcceptorCount:
__

HydrogenBondDonorCount:
__

RotatableBondCount:
__

Xlogp3:
__

Img

A2B Chem

AA31571

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CatalogNumber:
__

ChemicalName:
__

CasNumber:
__

MolecularFormula:
__

MolecularWeight:
__

MdlNumber:
__

Smiles:
S=C(c1ccc(cc1)C(F)(F)F)Nc1ccc(cc1C)[N+](=O)[O-]

Complexity:
__

Covalently-bondedUnitCount:
__

HeavyAtomCount:
__

HydrogenBondAcceptorCount:
__

HydrogenBondDonorCount:
__

RotatableBondCount:
__

Xlogp3:
__

Img

A2B Chem

AA31572

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CatalogNumber:
__

ChemicalName:
__

CasNumber:
__

MolecularFormula:
__

MolecularWeight:
__

MdlNumber:
__

Smiles:
S=C(c1ccc(cc1)C(F)(F)F)Nc1ccc(cc1)[N+](=O)[O-]

Complexity:
__

Covalently-bondedUnitCount:
__

HeavyAtomCount:
__

HydrogenBondAcceptorCount:
__

HydrogenBondDonorCount:
__

RotatableBondCount:
__

Xlogp3:
__