Name: Name:2-(chloromethyl)-1-ethyl-5-(piperidine-1-sulfonyl)-1H-1,3-benzodiazole
Brand: Angene
SKU: AG019JYH
Rating: 90 (10 reviews)

2-(chloromethyl)-1-ethyl-5-(piperidine-1-sulfonyl)-1H-1,3-benzodiazole

CAS No.:

785792-45-2

Catalog Number:

AG019JYH

Molecular Formula:

C15H20ClN3O2S

Molecular Weight:

341.8562

Catalog Number:

AG019JYH

Chemical Name:

2-(chloromethyl)-1-ethyl-5-(piperidine-1-sulfonyl)-1H-1,3-benzodiazole

CAS Number:

785792-45-2

Molecular Formula:

C15H20ClN3O2S

Molecular Weight:

341.8562

MDL Number:

MFCD06351004

IUPAC Name:

2-(chloromethyl)-1-ethyl-5-piperidin-1-ylsulfonylbenzimidazole

InChI:

InChI=1S/C15H20ClN3O2S/c1-2-19-14-7-6-12(10-13(14)17-15(19)11-16)22(20,21)18-8-4-3-5-9-18/h6-7,10H,2-5,8-9,11H2,1H3

InChI Key:

LFZOAQKFRFNKEO-UHFFFAOYSA-N

SMILES:

ClCc1nc2c(n1CC)ccc(c2)S(=O)(=O)N1CCCCC1

Complexity:

476

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

341.096g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

341.854g/mol

Monoisotopic Mass:

341.096g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

63.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.2