AF00656

1437794-85-8 | N-Isopropyl 5-nitropicolinamide

Manufacturer: A2B Chem

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CatalogNumber

AF00656

ChemicalName

N-Isopropyl 5-nitropicolinamide

CasNumber

1437794-85-8

MolecularFormula

C9H11N3O3

MolecularWeight

209.2019

MdlNumber

MFCD24448821

Smiles

CC(NC(=O)c1ccc(cn1)[N+](=O)[O-])C

Complexity

250

Covalently-bondedUnitCount

1

HeavyAtomCount

15

HydrogenBondAcceptorCount

4

HydrogenBondDonorCount

1

RotatableBondCount

2

Xlogp3

1.1

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A2B Chem

AF00656

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CatalogNumber:
AF00656

ChemicalName:
N-Isopropyl 5-nitropicolinamide

CasNumber:
1437794-85-8

MolecularFormula:
C9H11N3O3

MolecularWeight:
209.2019

MdlNumber:
MFCD24448821

Smiles:
CC(NC(=O)c1ccc(cn1)[N+](=O)[O-])C

Complexity:
250

Covalently-bondedUnitCount:
1

HeavyAtomCount:
15

HydrogenBondAcceptorCount:
4

HydrogenBondDonorCount:
1

RotatableBondCount:
2

Xlogp3:
1.1

Img

A2B Chem

AF00657

--


CatalogNumber:
__

ChemicalName:
__

CasNumber:
__

MolecularFormula:
__

MolecularWeight:
__

MdlNumber:
__

Smiles:
COc1cc(C=O)cc(c1)c1ccc(cc1)C#N

Complexity:
__

Covalently-bondedUnitCount:
__

HeavyAtomCount:
__

HydrogenBondAcceptorCount:
__

HydrogenBondDonorCount:
__

RotatableBondCount:
__

Xlogp3:
__

Img

A2B Chem

AF00658

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CatalogNumber:
AF00658

ChemicalName:
2-Hydroxy-3-methyl-2-phenylbutanoic acid

CasNumber:
15879-60-4

MolecularFormula:
C11H14O3

MolecularWeight:
194.2271

MdlNumber:
MFCD00021679

Smiles:
CC(C(c1ccccc1)(C(=O)O)O)C

Complexity:
207

Covalently-bondedUnitCount:
1

HeavyAtomCount:
14

HydrogenBondAcceptorCount:
3

HydrogenBondDonorCount:
2

RotatableBondCount:
3

Xlogp3:
2

Img

A2B Chem

AF00659

--


CatalogNumber:
AF00659

ChemicalName:
Methyl 4-chloro-3-(methylsulfanyl)benzoate

CasNumber:
166811-70-7

MolecularFormula:
C9H9ClO2S

MolecularWeight:
216.6846

MdlNumber:
MFCD22489119

Smiles:
COC(=O)c1ccc(c(c1)SC)Cl

Complexity:
187

Covalently-bondedUnitCount:
1

HeavyAtomCount:
13

HydrogenBondAcceptorCount:
3

HydrogenBondDonorCount:
__

RotatableBondCount:
3

Xlogp3:
2.9