Name: Name:4-[2-amino-4-(trifluoromethyl)phenyl]-1lambda6-thiomorpholine-1,1-dione
Brand: Angene
SKU: AG01A0BY
Rating: 90 (10 reviews)

4-[2-amino-4-(trifluoromethyl)phenyl]-1lambda6-thiomorpholine-1,1-dione

CAS No.:

861881-11-0

Catalog Number:

AG01A0BY

Molecular Formula:

C11H13F3N2O2S

Molecular Weight:

294.2933

Catalog Number:

AG01A0BY

Chemical Name:

4-[2-amino-4-(trifluoromethyl)phenyl]-1lambda6-thiomorpholine-1,1-dione

CAS Number:

861881-11-0

Molecular Formula:

C11H13F3N2O2S

Molecular Weight:

294.2933

MDL Number:

MFCD12569406

IUPAC Name:

2-(1,1-dioxo-1,4-thiazinan-4-yl)-5-(trifluoromethyl)aniline

InChI:

InChI=1S/C11H13F3N2O2S/c12-11(13,14)8-1-2-10(9(15)7-8)16-3-5-19(17,18)6-4-16/h1-2,7H,3-6,15H2

InChI Key:

NAJGKCZNYWUQJD-UHFFFAOYSA-N

SMILES:

Nc1cc(ccc1N1CCS(=O)(=O)CC1)C(F)(F)F

Complexity:

405

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

294.065g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

294.292g/mol

Monoisotopic Mass:

294.065g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

71.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.4