Catalog No.:AA002JAG

207971-23-1 | Benzoic acid, 2-[[21-[(3aS,4S,6aR)-hexahydro-2-oxo-1H-thieno[3,4-d]imidazol-4-yl]-10,17-dioxo-3,6-dioxa-9,16-diazaheneicos-1-yl]oxy]-4-[3-(trifluoromethyl)-3H-diazirin-3-yl]-

Name: Name:Benzoic acid, 2-[[21-[(3aS,4S,6aR)-hexahydro-2-oxo-1H-thieno[3,4-d]imidazol-4-yl]-10,17-dioxo-3,6-dioxa-9,16-diazaheneicos-1-yl]oxy]-4-[3-(trifluoromethyl)-3H-diazirin-3-yl]-
Brand: AABLOCKS
SKU: AA002JAG
Rating: 90 (10 reviews)

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Technical Information

Catalog Number:

AA002JAG

Chemical Name:

Benzoic acid, 2-[[21-[(3aS,4S,6aR)-hexahydro-2-oxo-1H-thieno[3,4-d]imidazol-4-yl]-10,17-dioxo-3,6-dioxa-9,16-diazaheneicos-1-yl]oxy]-4-[3-(trifluoromethyl)-3H-diazirin-3-yl]-

CAS Number:

207971-23-1

Molecular Formula:

C31H43F3N6O8S

Molecular Weight:

716.7687

MDL Number:

MFCD07369145

SMILES:

O=C(NCCOCCOCCOc1cc(ccc1C(=O)O)C1(N=N1)C(F)(F)F)CCCCCNC(=O)CCCC[C@@H]1SC[C@H]2[C@@H]1NC(=O)N2

Properties

Computed Properties

Complexity:

1150

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Rotatable Bond Count:

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.3

Literature

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Tags:207971-23-1 Molecular Formula|207971-23-1 MDL|207971-23-1 SMILES|207971-23-1 Benzoic acid, 2-[[21-[(3aS,4S,6aR)-hexahydro-2-oxo-1H-thieno[3,4-d]imidazol-4-yl]-10,17-dioxo-3,6-dioxa-9,16-diazaheneicos-1-yl]oxy]-4-[3-(trifluoromethyl)-3H-diazirin-3-yl]-

Catalog No.: AA002JAG

207971-23-1 | Benzoic acid, 2-[[21-[(3aS,4S,6aR)-hexahydro-2-oxo-1H-thieno[3,4-d]imidazol-4-yl]-10,17-dioxo-3,6-dioxa-9,16-diazaheneicos-1-yl]oxy]-4-[3-(trifluoromethyl)-3H-diazirin-3-yl]-

This product is typically in stock,please click "Inquire" below or contact us at [email protected]for pricing and availability information.

Inquire

Technical Information

Catalog Number: AA002JAG

Chemical Name: Benzoic acid, 2-[[21-[(3aS,4S,6aR)-hexahydro-2-oxo-1H-thieno[3,4-d]imidazol-4-yl]-10,17-dioxo-3,6-dioxa-9,16-diazaheneicos-1-yl]oxy]-4-[3-(trifluoromethyl)-3H-diazirin-3-yl]-

CAS Number: 207971-23-1

Molecular Formula: C31H43F3N6O8S

Molecular Weight: 716.7687

MDL Number: MFCD07369145

SMILES: O=C(NCCOCCOCCOc1cc(ccc1C(=O)O)C1(N=N1)C(F)(F)F)CCCCCNC(=O)CCCC[C@@H]1SC[C@H]2[C@@H]1NC(=O)N2

Properties

Complexity: 1150

Covalently-Bonded Unit Count: 1

Defined Atom Stereocenter Count: 3

Defined Bond Stereocenter Count: 0

Formal Charge: 0

Heavy Atom Count: 49