Name: Name:Benzo[b]thiophene-3-carboxamide, 2-[(2-chloroacetyl)amino]-4,5,6,7-tetrahydro-
Brand: Angene
SKU: AG002JY1
Rating: 90 (10 reviews)

Benzo[b]thiophene-3-carboxamide, 2-[(2-chloroacetyl)amino]-4,5,6,7-tetrahydro-

CAS No.:

20886-87-7

Catalog Number:

AG002JY1

Molecular Formula:

C11H13ClN2O2S

Molecular Weight:

272.7511

Catalog Number:

AG002JY1

Chemical Name:

Benzo[b]thiophene-3-carboxamide, 2-[(2-chloroacetyl)amino]-4,5,6,7-tetrahydro-

CAS Number:

20886-87-7

Molecular Formula:

C11H13ClN2O2S

Molecular Weight:

272.7511

MDL Number:

MFCD00226747

IUPAC Name:

2-[(2-chloroacetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

InChI:

InChI=1S/C11H13ClN2O2S/c12-5-8(15)14-11-9(10(13)16)6-3-1-2-4-7(6)17-11/h1-5H2,(H2,13,16)(H,14,15)

InChI Key:

XRKRPMKJSPGFRD-UHFFFAOYSA-N

SMILES:

ClCC(=O)Nc1sc2c(c1C(=O)N)CCCC2

Complexity:

327

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

272.039g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

272.747g/mol

Monoisotopic Mass:

272.039g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

100A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.4