Name: Name:2H-Benzimidazole-2-thione, 5-chloro-1,3-dihydro-1-(phenylmethyl)-
Brand: Angene
SKU: AG00H987
Rating: 90 (10 reviews)

2H-Benzimidazole-2-thione, 5-chloro-1,3-dihydro-1-(phenylmethyl)-

CAS No.:

100440-60-6

Catalog Number:

AG00H987

Molecular Formula:

C14H11ClN2S

Molecular Weight:

274.7685

Catalog Number:

AG00H987

Chemical Name:

2H-Benzimidazole-2-thione, 5-chloro-1,3-dihydro-1-(phenylmethyl)-

CAS Number:

100440-60-6

Molecular Formula:

C14H11ClN2S

Molecular Weight:

274.7685

MDL Number:

MFCD01136171

IUPAC Name:

3-benzyl-6-chloro-1H-benzimidazole-2-thione

InChI:

InChI=1S/C14H11ClN2S/c15-11-6-7-13-12(8-11)16-14(18)17(13)9-10-4-2-1-3-5-10/h1-8H,9H2,(H,16,18)

InChI Key:

OUPMSORROMFUIY-UHFFFAOYSA-N

SMILES:

Clc1ccc2c(c1)nc(n2Cc1ccccc1)S

Complexity:

317

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

274.033g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

274.766g/mol

Monoisotopic Mass:

274.033g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

47.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.5