AG69131

618385-01-6 | Vorapaxar

Manufacturer: A2B Chem

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CatalogNumber

AG69131

ChemicalName

Vorapaxar

CasNumber

618385-01-6

MolecularFormula

C29H33FN2O4

MolecularWeight

492.5817

MdlNumber

MFCD16038876

Smiles

CCOC(=O)N[C@@H]1CC[C@@H]2[C@@H](C1)C[C@@H]1[C@H]([C@H]2/C=C/c2ccc(cn2)c2cccc(c2)F)[C@H](OC1=O)C

Complexity

821

Covalently-bondedUnitCount

1

DefinedAtomStereocenterCount

7

DefinedBondStereocenterCount

1

HeavyAtomCount

36

HydrogenBondAcceptorCount

6

HydrogenBondDonorCount

1

RotatableBondCount

6

Xlogp3

5.3

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Img

A2B Chem

AG69131

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CatalogNumber:
AG69131

ChemicalName:
Vorapaxar

CasNumber:
618385-01-6

MolecularFormula:
C29H33FN2O4

MolecularWeight:
492.5817

MdlNumber:
MFCD16038876

Smiles:
CCOC(=O)N[C@@H]1CC[C@@H]2[C@@H](C1)C[C@@H]1[C@H]([C@H]2/C=C/c2ccc(cn2)c2cccc(c2)F)[C@H](OC1=O)C

Complexity:
821

Covalently-bondedUnitCount:
1

DefinedAtomStereocenterCount:
7

DefinedBondStereocenterCount:
1

HeavyAtomCount:
36

HydrogenBondAcceptorCount:
6

HydrogenBondDonorCount:
1

RotatableBondCount:
6

Xlogp3:
5.3

Img

A2B Chem

AG69132

--


CatalogNumber:
__

ChemicalName:
__

CasNumber:
__

MolecularFormula:
__

MolecularWeight:
__

MdlNumber:
__

Smiles:
BrCC1(OCCO1)c1ccc(cc1)C#N

Complexity:
__

Covalently-bondedUnitCount:
__

DefinedAtomStereocenterCount:
__

DefinedBondStereocenterCount:
__

HeavyAtomCount:
__

HydrogenBondAcceptorCount:
__

HydrogenBondDonorCount:
__

RotatableBondCount:
__

Xlogp3:
__

Img

A2B Chem

AG69133

--


CatalogNumber:
__

ChemicalName:
__

CasNumber:
__

MolecularFormula:
__

MolecularWeight:
__

MdlNumber:
__

Smiles:
CCOc1nc2c(n1C)c(=O)n(c(=O)n2C)C

Complexity:
__

Covalently-bondedUnitCount:
__

DefinedAtomStereocenterCount:
__

DefinedBondStereocenterCount:
__

HeavyAtomCount:
__

HydrogenBondAcceptorCount:
__

HydrogenBondDonorCount:
__

RotatableBondCount:
__

Xlogp3:
__

Img

A2B Chem

AG69134

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CatalogNumber:
AG69134

ChemicalName:
2-Amino-5-ethoxypyrazine

CasNumber:
647843-58-1

MolecularFormula:
C6H9N3O

MolecularWeight:
139.1552

MdlNumber:
MFCD09909690

Smiles:
CCOc1cnc(cn1)N

Complexity:
99

Covalently-bondedUnitCount:
1

DefinedAtomStereocenterCount:
__

DefinedBondStereocenterCount:
__

HeavyAtomCount:
10

HydrogenBondAcceptorCount:
4

HydrogenBondDonorCount:
1

RotatableBondCount:
2

Xlogp3:
0.7