Name: Name:1-{1-[(2-chloro-4-fluorophenyl)methyl]piperidin-4-yl}-2,3-dihydro-1H-1,3-benzodiazol-2-one
Brand: Angene
SKU: AG01B9UB
Rating: 90 (10 reviews)

1-{1-[(2-chloro-4-fluorophenyl)methyl]piperidin-4-yl}-2,3-dihydro-1H-1,3-benzodiazol-2-one

CAS No.:

909682-49-1

Catalog Number:

AG01B9UB

Molecular Formula:

C19H19ClFN3O

Molecular Weight:

359.8251

Catalog Number:

AG01B9UB

Chemical Name:

1-{1-[(2-chloro-4-fluorophenyl)methyl]piperidin-4-yl}-2,3-dihydro-1H-1,3-benzodiazol-2-one

CAS Number:

909682-49-1

Molecular Formula:

C19H19ClFN3O

Molecular Weight:

359.8251

MDL Number:

MFCD08566377

IUPAC Name:

3-[1-[(2-chloro-4-fluorophenyl)methyl]piperidin-4-yl]-1H-benzimidazol-2-one

InChI:

InChI=1S/C19H19ClFN3O/c20-16-11-14(21)6-5-13(16)12-23-9-7-15(8-10-23)24-18-4-2-1-3-17(18)22-19(24)25/h1-6,11,15H,7-10,12H2,(H,22,25)

InChI Key:

TXZJOEVZPMGIRW-UHFFFAOYSA-N

SMILES:

Fc1ccc(c(c1)Cl)CN1CCC(CC1)n1c(=O)[nH]c2c1cccc2

Complexity:

485

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

359.12g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

359.829g/mol

Monoisotopic Mass:

359.12g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

35.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.2