Name: Name:2-({5,6-dioxospiro[pyrrolidine-3,1-pyrrolo[2,1-c][1λ2,2,4]triazine]-1-yl}carbonyloxy)-2-methylpropylidyne
Brand: Angene
SKU: AG01DTJO
Rating: 90 (10 reviews)

2-({5,6-dioxospiro[pyrrolidine-3,1-pyrrolo[2,1-c][1λ2,2,4]triazine]-1-yl}carbonyloxy)-2-methylpropylidyne

CAS No.:

1290627-16-5

Catalog Number:

AG01DTJO

Molecular Formula:

C14H20N4O4

Molecular Weight:

308.3330

Catalog Number:

AG01DTJO

Chemical Name:

2-({5,6-dioxospiro[pyrrolidine-3,1-pyrrolo[2,1-c][1λ2,2,4]triazine]-1-yl}carbonyloxy)-2-methylpropylidyne

CAS Number:

1290627-16-5

Molecular Formula:

C14H20N4O4

Molecular Weight:

308.3330

MDL Number:

MFCD19442332

IUPAC Name:

tert-butyl 3,4-dioxospiro[6,7-dihydro-2H-pyrrolo[2,1-c][1,2,4]triazine-8,3'-pyrrolidine]-1'-carboxylate

InChI:

InChI=1S/C14H20N4O4/c1-13(2,3)22-12(21)17-6-4-14(8-17)5-7-18-10(20)9(19)15-16-11(14)18/h4-8H2,1-3H3,(H,15,19)

InChI Key:

NUJSJAQWRHTMJA-UHFFFAOYSA-N

SMILES:

O=C(N1CCC2(C1)CCn1c2n[nH]c(=O)c1=O)OC(C)(C)C

Complexity:

580

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

308.148g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

308.338g/mol

Monoisotopic Mass:

308.148g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

91.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.2