Name: Name:4-amino-5-thiatricyclo[8.4.0.0,2,6]tetradeca-1(14),2(6),3,10,12-pentaene-3-carboxamide
Brand: Angene
SKU: AG01AAN7
Rating: 90 (10 reviews)

4-amino-5-thiatricyclo[8.4.0.0,2,6]tetradeca-1(14),2(6),3,10,12-pentaene-3-carboxamide

CAS No.:

954260-58-3

Catalog Number:

AG01AAN7

Molecular Formula:

C14H14N2OS

Molecular Weight:

258.3388

Catalog Number:

AG01AAN7

Chemical Name:

4-amino-5-thiatricyclo[8.4.0.0,2,6]tetradeca-1(14),2(6),3,10,12-pentaene-3-carboxamide

CAS Number:

954260-58-3

Molecular Formula:

C14H14N2OS

Molecular Weight:

258.3388

MDL Number:

MFCD09738547

IUPAC Name:

4-amino-5-thiatricyclo[8.4.0.02,6]tetradeca-1(14),2(6),3,10,12-pentaene-3-carboxamide

InChI:

InChI=1S/C14H14N2OS/c15-13(17)12-11-9-6-2-1-4-8(9)5-3-7-10(11)18-14(12)16/h1-2,4,6H,3,5,7,16H2,(H2,15,17)

InChI Key:

BTQFGPINIMTFIE-UHFFFAOYSA-N

SMILES:

NC(=O)c1c(N)sc2c1c1ccccc1CCC2

Complexity:

336

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

258.083g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

258.339g/mol

Monoisotopic Mass:

258.083g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

97.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3: