Name: Name:1-{3-amino-8-oxa-4-thia-1,2-diazaspiro[4.5]dec-2-en-1-yl}ethan-1-one
Brand: Angene
SKU: AG01BG6W
Rating: 90 (10 reviews)

1-{3-amino-8-oxa-4-thia-1,2-diazaspiro[4.5]dec-2-en-1-yl}ethan-1-one

CAS No.:

1795500-98-9

Catalog Number:

AG01BG6W

Molecular Formula:

C8H13N3O2S

Molecular Weight:

215.2727

Catalog Number:

AG01BG6W

Chemical Name:

1-{3-amino-8-oxa-4-thia-1,2-diazaspiro[4.5]dec-2-en-1-yl}ethan-1-one

CAS Number:

1795500-98-9

Molecular Formula:

C8H13N3O2S

Molecular Weight:

215.2727

MDL Number:

MFCD28139378

IUPAC Name:

1-(2-amino-8-oxa-1-thia-3,4-diazaspiro[4.5]dec-2-en-4-yl)ethanone

InChI:

InChI=1S/C8H13N3O2S/c1-6(12)11-8(14-7(9)10-11)2-4-13-5-3-8/h2-5H2,1H3,(H2,9,10)

InChI Key:

PSBMEXIERLCKLZ-UHFFFAOYSA-N

SMILES:

CC(=O)N1N=C(SC21CCOCC2)N

Complexity:

286

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

215.073g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

215.271g/mol

Monoisotopic Mass:

215.073g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

93.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.1