Name: Name:octahydro-2H-1,4-benzothiazine-1,1-dione, Mixture of diastereomers
Brand: Angene
SKU: AG01AHN0
Rating: 90 (10 reviews)

octahydro-2H-1,4-benzothiazine-1,1-dione, Mixture of diastereomers

CAS No.:

1334147-44-2

Catalog Number:

AG01AHN0

Molecular Formula:

C8H15NO2S

Molecular Weight:

189.2752

Catalog Number:

AG01AHN0

Chemical Name:

octahydro-2H-1,4-benzothiazine-1,1-dione, Mixture of diastereomers

CAS Number:

1334147-44-2

Molecular Formula:

C8H15NO2S

Molecular Weight:

189.2752

MDL Number:

MFCD19686218

IUPAC Name:

3,4,4a,5,6,7,8,8a-octahydro-2H-benzo[b][1,4]thiazine 1,1-dioxide

InChI:

InChI=1S/C8H15NO2S/c10-12(11)6-5-9-7-3-1-2-4-8(7)12/h7-9H,1-6H2

InChI Key:

JJYGRMQMWFERJD-UHFFFAOYSA-N

SMILES:

O=S1(=O)CCNC2C1CCCC2

Complexity:

255

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

189.082g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

189.273g/mol

Monoisotopic Mass:

189.082g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

54.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.3