Name: Name:2-(4-(tert-Butoxycarbonyl)piperazin-1-yl)thiazole-4-carboxylic acid
Brand: Angene
SKU: AG006QE1
Rating: 90 (10 reviews)

2-(4-(tert-Butoxycarbonyl)piperazin-1-yl)thiazole-4-carboxylic acid

CAS No.:

668484-45-5

Catalog Number:

AG006QE1

Molecular Formula:

C13H19N3O4S

Molecular Weight:

313.3727

Catalog Number:

AG006QE1

Chemical Name:

2-(4-(tert-Butoxycarbonyl)piperazin-1-yl)thiazole-4-carboxylic acid

CAS Number:

668484-45-5

Molecular Formula:

C13H19N3O4S

Molecular Weight:

313.3727

MDL Number:

MFCD13193290

IUPAC Name:

2-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]-1,3-thiazole-4-carboxylic acid

InChI:

InChI=1S/C13H19N3O4S/c1-13(2,3)20-12(19)16-6-4-15(5-7-16)11-14-9(8-21-11)10(17)18/h8H,4-7H2,1-3H3,(H,17,18)

InChI Key:

FMSFMUBALWPCQM-UHFFFAOYSA-N

SMILES:

O=C(N1CCN(CC1)c1scc(n1)C(=O)O)OC(C)(C)C

Complexity:

405

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

313.11g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

313.372g/mol

Monoisotopic Mass:

313.11g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

111A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.9