Name: Name:3-(4-tert-butylbenzoyl)-1,3-thiazolidine-4-carboxylic acid
Brand: Angene
SKU: AG01AACG
Rating: 90 (10 reviews)

3-(4-tert-butylbenzoyl)-1,3-thiazolidine-4-carboxylic acid

CAS No.:

1009534-13-7

Catalog Number:

AG01AACG

Molecular Formula:

C15H19NO3S

Molecular Weight:

293.3813

Catalog Number:

AG01AACG

Chemical Name:

3-(4-tert-butylbenzoyl)-1,3-thiazolidine-4-carboxylic acid

CAS Number:

1009534-13-7

Molecular Formula:

C15H19NO3S

Molecular Weight:

293.3813

MDL Number:

MFCD09931095

IUPAC Name:

3-(4-tert-butylbenzoyl)-1,3-thiazolidine-4-carboxylic acid

InChI:

InChI=1S/C15H19NO3S/c1-15(2,3)11-6-4-10(5-7-11)13(17)16-9-20-8-12(16)14(18)19/h4-7,12H,8-9H2,1-3H3,(H,18,19)

InChI Key:

DWQBUXLRDLZXCD-UHFFFAOYSA-N

SMILES:

O=C(c1ccc(cc1)C(C)(C)C)N1CSCC1C(=O)O

Complexity:

383

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

293.109g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

293.381g/mol

Monoisotopic Mass:

293.109g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

82.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.2