Name: Name:3-(2-bromo-4-methylbenzoyl)-4H,5H,6H-cyclopenta[b]thiophen-2-amine
Brand: Angene
SKU: AG01BD5K
Rating: 90 (10 reviews)

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

CAS No.:

1798742-74-1

Catalog Number:

AG01BD5K

Molecular Formula:

C15H14BrNOS

Molecular Weight:

336.2468

Catalog Number:

AG01BD5K

Chemical Name:

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

CAS Number:

1798742-74-1

Molecular Formula:

C15H14BrNOS

Molecular Weight:

336.2468

MDL Number:

MFCD28023776

IUPAC Name:

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

InChI:

InChI=1S/C15H14BrNOS/c1-8-5-6-9(11(16)7-8)14(18)13-10-3-2-4-12(10)19-15(13)17/h5-7H,2-4,17H2,1H3

InChI Key:

IBOKUVJFLKVOKW-UHFFFAOYSA-N

SMILES:

Cc1ccc(c(c1)Br)C(=O)c1c(N)sc2c1CCC2

Complexity:

364

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

334.998g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

336.247g/mol

Monoisotopic Mass:

334.998g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

71.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.9