Name: Name:methyl 2-amino-4,5,6,7-tetrahydro-1,3-benzothiazole-5-carboxylate
Brand: Angene
SKU: AG01C3IJ
Rating: 90 (10 reviews)

methyl 2-amino-4,5,6,7-tetrahydro-1,3-benzothiazole-5-carboxylate

CAS No.:

1909348-03-3

Catalog Number:

AG01C3IJ

Molecular Formula:

C9H12N2O2S

Molecular Weight:

212.2688

Catalog Number:

AG01C3IJ

Chemical Name:

methyl 2-amino-4,5,6,7-tetrahydro-1,3-benzothiazole-5-carboxylate

CAS Number:

1909348-03-3

Molecular Formula:

C9H12N2O2S

Molecular Weight:

212.2688

MDL Number:

MFCD29762810

IUPAC Name:

methyl 2-amino-4,5,6,7-tetrahydro-1,3-benzothiazole-5-carboxylate

InChI:

InChI=1S/C9H12N2O2S/c1-13-8(12)5-2-3-7-6(4-5)11-9(10)14-7/h5H,2-4H2,1H3,(H2,10,11)

InChI Key:

FSQGWGDUPYAXNO-UHFFFAOYSA-N

SMILES:

COC(=O)C1CCc2c(C1)nc(s2)N

Complexity:

237

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

212.062g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

212.267g/mol

Monoisotopic Mass:

212.062g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

93.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.2