AA14915

116118-98-0 | 4,5,6,7-Tetrahydrothieno[3,2-c]pyridine-2-carboxylic acid

Manufacturer: A2B Chem

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CatalogNumber

AA14915

ChemicalName

4,5,6,7-Tetrahydrothieno[3,2-c]pyridine-2-carboxylic acid

CasNumber

116118-98-0

MolecularFormula

C8H9NO2S

MolecularWeight

183.22756

MdlNumber

MFCD08696382

Smiles

OC(=O)c1cc2c(s1)CCNC2

Complexity

198

Covalently-bondedUnitCount

1

HeavyAtomCount

12

HydrogenBondAcceptorCount

4

HydrogenBondDonorCount

2

RotatableBondCount

1

Xlogp3

-1.4

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Show Difference

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A2B Chem

AA14915

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CatalogNumber:
AA14915

ChemicalName:
4,5,6,7-Tetrahydrothieno[3,2-c]pyridine-2-carboxylic acid

CasNumber:
116118-98-0

MolecularFormula:
C8H9NO2S

MolecularWeight:
183.22756

MdlNumber:
MFCD08696382

Smiles:
OC(=O)c1cc2c(s1)CCNC2

Complexity:
198

Covalently-bondedUnitCount:
1

HeavyAtomCount:
12

HydrogenBondAcceptorCount:
4

HydrogenBondDonorCount:
2

RotatableBondCount:
1

Xlogp3:
-1.4

Img

A2B Chem

AA14929

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CatalogNumber:
__

ChemicalName:
__

CasNumber:
__

MolecularFormula:
__

MolecularWeight:
__

MdlNumber:
__

Smiles:
Cc1cccc(c1)c1nccnc1N

Complexity:
__

Covalently-bondedUnitCount:
__

HeavyAtomCount:
__

HydrogenBondAcceptorCount:
__

HydrogenBondDonorCount:
__

RotatableBondCount:
__

Xlogp3:
__

Img

A2B Chem

AA14940

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CatalogNumber:
__

ChemicalName:
__

CasNumber:
__

MolecularFormula:
__

MolecularWeight:
__

MdlNumber:
__

Smiles:
C[C@H]1COC2(O1)CCN(CC2)c1nc(=O)c2c(s1)c(cc(c2)C(F)(F)F)[N+](=O)[O-]

Complexity:
__

Covalently-bondedUnitCount:
__

HeavyAtomCount:
__

HydrogenBondAcceptorCount:
__

HydrogenBondDonorCount:
__

RotatableBondCount:
__

Xlogp3:
__

Img

A2B Chem

AA14941

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CatalogNumber:
__

ChemicalName:
__

CasNumber:
__

MolecularFormula:
__

MolecularWeight:
__

MdlNumber:
__

Smiles:
COc1cc(ccc1Cl)NC(=O)c1ccccn1

Complexity:
288

Covalently-bondedUnitCount:
__

HeavyAtomCount:
__

HydrogenBondAcceptorCount:
__

HydrogenBondDonorCount:
__

RotatableBondCount:
__

Xlogp3:
2.6