Name: Name:2,6-Diaza-spiro[3.4]octane-2,6,8-tricarboxylicacid6-benzylester2-tert-butyl ester
Brand: Angene
SKU: AG00HI17
Rating: 90 (10 reviews)

2,6-Diaza-spiro[3.4]octane-2,6,8-tricarboxylicacid6-benzylester2-tert-butyl ester

CAS No.:

1251011-09-2

Catalog Number:

AG00HI17

Molecular Formula:

C20H26N2O6

Molecular Weight:

390.4302

Catalog Number:

AG00HI17

Chemical Name:

2,6-Diaza-spiro[3.4]octane-2,6,8-tricarboxylicacid6-benzylester2-tert-butyl ester

CAS Number:

1251011-09-2

Molecular Formula:

C20H26N2O6

Molecular Weight:

390.4302

MDL Number:

MFCD18632606

IUPAC Name:

2-[(2-methylpropan-2-yl)oxycarbonyl]-7-phenylmethoxycarbonyl-2,7-diazaspiro[3.4]octane-5-carboxylic acid

InChI:

InChI=1S/C20H26N2O6/c1-19(2,3)28-18(26)22-12-20(13-22)11-21(9-15(20)16(23)24)17(25)27-10-14-7-5-4-6-8-14/h4-8,15H,9-13H2,1-3H3,(H,23,24)

InChI Key:

JEJZCYLNCZVMPL-UHFFFAOYSA-N

SMILES:

OC(=O)C1CN(CC21CN(C2)C(=O)OC(C)(C)C)C(=O)OCc1ccccc1

Complexity:

617

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

390.179g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

390.436g/mol

Monoisotopic Mass:

390.179g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

96.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.7