Name: Name:4H,5H,6H,7H,8H-thieno[3,2-c]azepin-4-one
Brand: Angene
SKU: AG01A9YS
Rating: 90 (10 reviews)

4H,5H,6H,7H,8H-thieno[3,2-c]azepin-4-one

CAS No.:

4751-59-1

Catalog Number:

AG01A9YS

Molecular Formula:

C8H9NOS

Molecular Weight:

167.2282

Catalog Number:

AG01A9YS

Chemical Name:

4H,5H,6H,7H,8H-thieno[3,2-c]azepin-4-one

CAS Number:

4751-59-1

Molecular Formula:

C8H9NOS

Molecular Weight:

167.2282

MDL Number:

MFCD19688417

IUPAC Name:

5,6,7,8-tetrahydrothieno[3,2-c]azepin-4-one

InChI:

InChI=1S/C8H9NOS/c10-8-6-3-5-11-7(6)2-1-4-9-8/h3,5H,1-2,4H2,(H,9,10)

InChI Key:

LKCFTLHJKOWHBT-UHFFFAOYSA-N

SMILES:

O=C1NCCCc2c1ccs2

Complexity:

172

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

167.04g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

167.226g/mol

Monoisotopic Mass:

167.04g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

57.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.3