Name: Name:3-(4-chloro-3-fluorobenzoyl)-4H,5H,6H-cyclopenta[b]thiophen-2-amine
Brand: Angene
SKU: AG01A55R
Rating: 90 (10 reviews)

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

CAS No.:

1443981-54-1

Catalog Number:

AG01A55R

Molecular Formula:

C14H11ClFNOS

Molecular Weight:

295.7596

Catalog Number:

AG01A55R

Chemical Name:

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

CAS Number:

1443981-54-1

Molecular Formula:

C14H11ClFNOS

Molecular Weight:

295.7596

MDL Number:

MFCD24842800

IUPAC Name:

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

InChI:

InChI=1S/C14H11ClFNOS/c15-9-5-4-7(6-10(9)16)13(18)12-8-2-1-3-11(8)19-14(12)17/h4-6H,1-3,17H2

InChI Key:

GMBOUMNYICQVBI-UHFFFAOYSA-N

SMILES:

Nc1sc2c(c1C(=O)c1ccc(c(c1)F)Cl)CCC2

Complexity:

369

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

295.023g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

295.756g/mol

Monoisotopic Mass:

295.023g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

71.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.6