Name: Name:5-{[(2-chlorophenyl)methyl]amino}-2,3-dihydro-1H-1,3-benzodiazol-2-one
Brand: Angene
SKU: AG01AJ05
Rating: 90 (10 reviews)

5-{[(2-chlorophenyl)methyl]amino}-2,3-dihydro-1H-1,3-benzodiazol-2-one

CAS No.:

884994-37-0

Catalog Number:

AG01AJ05

Molecular Formula:

C14H12ClN3O

Molecular Weight:

273.7176

Catalog Number:

AG01AJ05

Chemical Name:

5-{[(2-chlorophenyl)methyl]amino}-2,3-dihydro-1H-1,3-benzodiazol-2-one

CAS Number:

884994-37-0

Molecular Formula:

C14H12ClN3O

Molecular Weight:

273.7176

MDL Number:

MFCD07611143

IUPAC Name:

5-[(2-chlorophenyl)methylamino]-1,3-dihydrobenzimidazol-2-one

InChI:

InChI=1S/C14H12ClN3O/c15-11-4-2-1-3-9(11)8-16-10-5-6-12-13(7-10)18-14(19)17-12/h1-7,16H,8H2,(H2,17,18,19)

InChI Key:

LWJVCVCOKMYSSH-UHFFFAOYSA-N

SMILES:

Clc1ccccc1CNc1ccc2c(c1)[nH]c(=O)[nH]2

Complexity:

339

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

273.067g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

273.72g/mol

Monoisotopic Mass:

273.067g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

53.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.7