Name: Name:1-{4-[(2,4-dimethylphenyl)sulfanyl]phenyl}piperazine
Brand: Angene
SKU: AG01EHX0
Rating: 90 (10 reviews)

1-{4-[(2,4-dimethylphenyl)sulfanyl]phenyl}piperazine

CAS No.:

1815608-51-5

Catalog Number:

AG01EHX0

Molecular Formula:

C18H22N2S

Molecular Weight:

298.4457

Catalog Number:

AG01EHX0

Chemical Name:

1-{4-[(2,4-dimethylphenyl)sulfanyl]phenyl}piperazine

CAS Number:

1815608-51-5

Molecular Formula:

C18H22N2S

Molecular Weight:

298.4457

MDL Number:

MFCD31439555

IUPAC Name:

1-[4-(2,4-dimethylphenyl)sulfanylphenyl]piperazine

InChI:

InChI=1S/C18H22N2S/c1-14-3-8-18(15(2)13-14)21-17-6-4-16(5-7-17)20-11-9-19-10-12-20/h3-8,13,19H,9-12H2,1-2H3

InChI Key:

ZWSWQSDJGJPXHD-UHFFFAOYSA-N

SMILES:

Cc1ccc(c(c1)C)Sc1ccc(cc1)N1CCNCC1

Complexity:

308

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

298.15g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

298.448g/mol

Monoisotopic Mass:

298.15g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

40.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.2