Name: Name:tert-butyl 2-amino-4-(1-methyl-1H-pyrazol-4-yl)thiophene-3-carboxylate
Brand: Angene
SKU: AG01EJGP
Rating: 90 (10 reviews)

tert-butyl 2-amino-4-(1-methyl-1H-pyrazol-4-yl)thiophene-3-carboxylate

CAS No.:

1556208-90-2

Catalog Number:

AG01EJGP

Molecular Formula:

C13H17N3O2S

Molecular Weight:

279.3580

Catalog Number:

AG01EJGP

Chemical Name:

tert-butyl 2-amino-4-(1-methyl-1H-pyrazol-4-yl)thiophene-3-carboxylate

CAS Number:

1556208-90-2

Molecular Formula:

C13H17N3O2S

Molecular Weight:

279.3580

MDL Number:

MFCD25239051

IUPAC Name:

tert-butyl 2-amino-4-(1-methylpyrazol-4-yl)thiophene-3-carboxylate

InChI:

InChI=1S/C13H17N3O2S/c1-13(2,3)18-12(17)10-9(7-19-11(10)14)8-5-15-16(4)6-8/h5-7H,14H2,1-4H3

InChI Key:

JMJQSYLXZANPPJ-UHFFFAOYSA-N

SMILES:

Cn1ncc(c1)c1csc(c1C(=O)OC(C)(C)C)N

Complexity:

345

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

279.104g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

279.358g/mol

Monoisotopic Mass:

279.104g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

98.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.6