Name: Name:2-(4-methylphenyl)-4,5,6,7-tetrahydro-1,3-benzothiazol-7-one
Brand: Angene
SKU: AG01AA3H
Rating: 90 (10 reviews)

2-(4-methylphenyl)-4,5,6,7-tetrahydro-1,3-benzothiazol-7-one

CAS No.:

1251924-63-6

Catalog Number:

AG01AA3H

Molecular Formula:

C14H13NOS

Molecular Weight:

243.3241

Catalog Number:

AG01AA3H

Chemical Name:

2-(4-methylphenyl)-4,5,6,7-tetrahydro-1,3-benzothiazol-7-one

CAS Number:

1251924-63-6

Molecular Formula:

C14H13NOS

Molecular Weight:

243.3241

MDL Number:

MFCD16817558

IUPAC Name:

2-(4-methylphenyl)-5,6-dihydro-4H-1,3-benzothiazol-7-one

InChI:

InChI=1S/C14H13NOS/c1-9-5-7-10(8-6-9)14-15-11-3-2-4-12(16)13(11)17-14/h5-8H,2-4H2,1H3

InChI Key:

DOIKXGZAVXQATN-UHFFFAOYSA-N

SMILES:

Cc1ccc(cc1)c1nc2c(s1)C(=O)CCC2

Complexity:

299

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

243.072g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

243.324g/mol

Monoisotopic Mass:

243.072g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

58.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.4