Name: Name:N-(4,5,6,7-tetrahydro-1H-1,3-benzodiazol-2-yl)acetamide
Brand: Angene
SKU: AG01AC1P
Rating: 90 (10 reviews)

N-(4,5,6,7-tetrahydro-1H-1,3-benzodiazol-2-yl)acetamide

CAS No.:

40639-93-8

Catalog Number:

AG01AC1P

Molecular Formula:

C9H13N3O

Molecular Weight:

179.2190

Catalog Number:

AG01AC1P

Chemical Name:

N-(4,5,6,7-tetrahydro-1H-1,3-benzodiazol-2-yl)acetamide

CAS Number:

40639-93-8

Molecular Formula:

C9H13N3O

Molecular Weight:

179.2190

MDL Number:

MFCD21336626

IUPAC Name:

N-(4,5,6,7-tetrahydro-1H-benzimidazol-2-yl)acetamide

InChI:

InChI=1S/C9H13N3O/c1-6(13)10-9-11-7-4-2-3-5-8(7)12-9/h2-5H2,1H3,(H2,10,11,12,13)

InChI Key:

DCHGWXCDPHNOHH-UHFFFAOYSA-N

SMILES:

CC(=O)Nc1nc2c([nH]1)CCCC2

Complexity:

207

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

179.106g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

179.223g/mol

Monoisotopic Mass:

179.106g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

57.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.7