Name: Name:5-HYDROXY-2-OXO-2,3-DIHYDRO-1H-[1]BENZAZEPHE-4-CARBOXYLIC ACID ETHYL ESTER
Brand: Angene
SKU: AG008WJJ
Rating: 90 (10 reviews)

5-HYDROXY-2-OXO-2,3-DIHYDRO-1H-[1]BENZAZEPHE-4-CARBOXYLIC ACID ETHYL ESTER

CAS No.:

108993-98-2

Catalog Number:

AG008WJJ

Molecular Formula:

Molecular Weight:

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Product Description

Catalog Number:

AG008WJJ

Chemical Name:

5-HYDROXY-2-OXO-2,3-DIHYDRO-1H-[1]BENZAZEPHE-4-CARBOXYLIC ACID ETHYL ESTER

CAS Number:

108993-98-2

MDL Number:

MFCD00666164

IUPAC Name:

ethyl 5-hydroxy-2-oxo-1,3-dihydro-1-benzazepine-4-carboxylate

InChI:

InChI=1S/C13H13NO4/c1-2-18-13(17)9-7-11(15)14-10-6-4-3-5-8(10)12(9)16/h3-6,16H,2,7H2,1H3,(H,14,15)

InChI Key:

PLGDATYQXDDDLF-UHFFFAOYSA-N

Properties

Complexity:

389

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

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Exact Mass:

247.084g/mol

Formal Charge:

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Molecular Weight:

247.25g/mol

Monoisotopic Mass:

247.084g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

75.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.4

Literature

Title	Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.	Bioorganic & medicinal chemistry letters 20101101

Properties