Name: Name:3-(2,4-dimethylbenzoyl)-4H,5H,6H-cyclopenta[b]thiophen-2-amine
Brand: Angene
SKU: AG01A5UB
Rating: 90 (10 reviews)

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

CAS No.:

1082778-95-7

Catalog Number:

AG01A5UB

Molecular Formula:

C16H17NOS

Molecular Weight:

271.3773

Catalog Number:

AG01A5UB

Chemical Name:

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

CAS Number:

1082778-95-7

Molecular Formula:

C16H17NOS

Molecular Weight:

271.3773

MDL Number:

MFCD11607096

IUPAC Name:

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

InChI:

InChI=1S/C16H17NOS/c1-9-6-7-11(10(2)8-9)15(18)14-12-4-3-5-13(12)19-16(14)17/h6-8H,3-5,17H2,1-2H3

InChI Key:

WTLOMMHGHMUZAC-UHFFFAOYSA-N

SMILES:

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

Complexity:

359

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

271.103g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

271.378g/mol

Monoisotopic Mass:

271.103g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

71.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.6