Name: Name:3-[4-(trifluoromethyl)benzoyl]-4H,5H,6H-cyclopenta[b]thiophen-2-amine
Brand: Angene
SKU: AG01A55U
Rating: 90 (10 reviews)

3-[4-(trifluoromethyl)benzoyl]-4H,5H,6H-cyclopenta[b]thiophen-2-amine

CAS No.:

1256257-04-1

Catalog Number:

AG01A55U

Molecular Formula:

C15H12F3NOS

Molecular Weight:

311.3221

Catalog Number:

AG01A55U

Chemical Name:

3-[4-(trifluoromethyl)benzoyl]-4H,5H,6H-cyclopenta[b]thiophen-2-amine

CAS Number:

1256257-04-1

Molecular Formula:

C15H12F3NOS

Molecular Weight:

311.3221

MDL Number:

MFCD24842803

IUPAC Name:

(2-amino-5,6-dihydro-4H-cyclopenta[b]thiophen-3-yl)-[4-(trifluoromethyl)phenyl]methanone

InChI:

InChI=1S/C15H12F3NOS/c16-15(17,18)9-6-4-8(5-7-9)13(20)12-10-2-1-3-11(10)21-14(12)19/h4-7H,1-3,19H2

InChI Key:

AJFYMPPLANPKJE-UHFFFAOYSA-N

SMILES:

Nc1sc2c(c1C(=O)c1ccc(cc1)C(F)(F)F)CCC2

Complexity:

406

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

311.059g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

311.322g/mol

Monoisotopic Mass:

311.059g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

71.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.7