Name: Name:4-[2-(1-aminoethyl)-1,3-thiazol-4-yl]benzonitrile
Brand: Angene
SKU: AG01A0H2
Rating: 90 (10 reviews)

4-[2-(1-aminoethyl)-1,3-thiazol-4-yl]benzonitrile

CAS No.:

1249162-37-5

Catalog Number:

AG01A0H2

Molecular Formula:

C12H11N3S

Molecular Weight:

229.3008

Catalog Number:

AG01A0H2

Chemical Name:

4-[2-(1-aminoethyl)-1,3-thiazol-4-yl]benzonitrile

CAS Number:

1249162-37-5

Molecular Formula:

C12H11N3S

Molecular Weight:

229.3008

MDL Number:

MFCD14628785

IUPAC Name:

4-[2-(1-aminoethyl)-1,3-thiazol-4-yl]benzonitrile

InChI:

InChI=1S/C12H11N3S/c1-8(14)12-15-11(7-16-12)10-4-2-9(6-13)3-5-10/h2-5,7-8H,14H2,1H3

InChI Key:

VFIFVTFLNDXWMW-UHFFFAOYSA-N

SMILES:

N#Cc1ccc(cc1)c1csc(n1)C(N)C

Complexity:

277

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

229.067g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

229.301g/mol

Monoisotopic Mass:

229.067g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

90.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.6