Name: Name:ethyl 2-(7-{[(tert-butoxy)carbonyl]amino}-4,5,6,7-tetrahydro-1H-indazol-1-yl)acetate
Brand: Angene
SKU: AG01AFW7
Rating: 90 (10 reviews)

ethyl 2-(7-{[(tert-butoxy)carbonyl]amino}-4,5,6,7-tetrahydro-1H-indazol-1-yl)acetate

CAS No.:

1803582-52-6

Catalog Number:

AG01AFW7

Molecular Formula:

C16H25N3O4

Molecular Weight:

323.3874

Catalog Number:

AG01AFW7

Chemical Name:

ethyl 2-(7-{[(tert-butoxy)carbonyl]amino}-4,5,6,7-tetrahydro-1H-indazol-1-yl)acetate

CAS Number:

1803582-52-6

Molecular Formula:

C16H25N3O4

Molecular Weight:

323.3874

MDL Number:

MFCD27920249

IUPAC Name:

ethyl 2-[7-[(2-methylpropan-2-yl)oxycarbonylamino]-4,5,6,7-tetrahydroindazol-1-yl]acetate

InChI:

InChI=1S/C16H25N3O4/c1-5-22-13(20)10-19-14-11(9-17-19)7-6-8-12(14)18-15(21)23-16(2,3)4/h9,12H,5-8,10H2,1-4H3,(H,18,21)

InChI Key:

AWNUPWIWQAWTQG-UHFFFAOYSA-N

SMILES:

CCOC(=O)Cn1ncc2c1C(CCC2)NC(=O)OC(C)(C)C

Complexity:

436

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

323.185g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

323.393g/mol

Monoisotopic Mass:

323.185g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

82.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.9