Name: Name:5-(TERT-BUTOXYCARBONYL)-5,6-DIHYDRO-4H-PYRROLO[3,4-D]THIAZOLE-2-CARBOXYLIC ACID
Brand: Angene
SKU: AG01DLYR
Rating: 90 (10 reviews)

5-(TERT-BUTOXYCARBONYL)-5,6-DIHYDRO-4H-PYRROLO[3,4-D]THIAZOLE-2-CARBOXYLIC ACID

CAS No.:

774533-81-2

Catalog Number:

AG01DLYR

Molecular Formula:

C11H14N2O4S

Molecular Weight:

270.3049

Catalog Number:

AG01DLYR

Chemical Name:

5-(TERT-BUTOXYCARBONYL)-5,6-DIHYDRO-4H-PYRROLO[3,4-D]THIAZOLE-2-CARBOXYLIC ACID

CAS Number:

774533-81-2

Molecular Formula:

C11H14N2O4S

Molecular Weight:

270.3049

IUPAC Name:

5-[(2-methylpropan-2-yl)oxycarbonyl]-4,6-dihydropyrrolo[3,4-d][1,3]thiazole-2-carboxylic acid

InChI:

InChI=1S/C11H14N2O4S/c1-11(2,3)17-10(16)13-4-6-7(5-13)18-8(12-6)9(14)15/h4-5H2,1-3H3,(H,14,15)

InChI Key:

HJCSXJBMSSXPGR-UHFFFAOYSA-N

SMILES:

O=C(N1Cc2c(C1)nc(s2)C(=O)O)OC(C)(C)C

Complexity:

369

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

270.067g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

270.303g/mol

Monoisotopic Mass:

270.067g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

108A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.1