Name: Name:3-(1,3-benzothiazol-2-yl)-4H,5H,6H-cyclopenta[b]thiophen-2-amine
Brand: Angene
SKU: AG01AHFI
Rating: 90 (10 reviews)

3-(1,3-benzothiazol-2-yl)-4H,5H,6H-cyclopenta[b]thiophen-2-amine

CAS No.:

522624-21-1

Catalog Number:

AG01AHFI

Molecular Formula:

C14H12N2S2

Molecular Weight:

272.3885

Catalog Number:

AG01AHFI

Chemical Name:

3-(1,3-benzothiazol-2-yl)-4H,5H,6H-cyclopenta[b]thiophen-2-amine

CAS Number:

522624-21-1

Molecular Formula:

C14H12N2S2

Molecular Weight:

272.3885

MDL Number:

MFCD03651646

IUPAC Name:

3-(1,3-benzothiazol-2-yl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-amine

InChI:

InChI=1S/C14H12N2S2/c15-13-12(8-4-3-7-10(8)17-13)14-16-9-5-1-2-6-11(9)18-14/h1-2,5-6H,3-4,7,15H2

InChI Key:

JYQDQPALXJXKNG-UHFFFAOYSA-N

SMILES:

Nc1sc2c(c1c1nc3c(s1)cccc3)CCC2

Complexity:

325

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

272.044g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

272.384g/mol

Monoisotopic Mass:

272.044g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

95.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.1