Name: Name:1-Oxo-2,9,13-triaza-dispiro[4.0.5.3]tetradecane-9,13-dicarboxylic acid 13-benzyl ester 9-tert-butyl ester
Brand: Angene
SKU: AG00HI0K
Rating: 90 (10 reviews)

1-Oxo-2,9,13-triaza-dispiro[4.0.5.3]tetradecane-9,13-dicarboxylic acid 13-benzyl ester 9-tert-butyl ester

CAS No.:

1251007-50-7

Catalog Number:

AG00HI0K

Molecular Formula:

C24H33N3O5

Molecular Weight:

443.5359

Catalog Number:

AG00HI0K

Chemical Name:

1-Oxo-2,9,13-triaza-dispiro[4.0.5.3]tetradecane-9,13-dicarboxylic acid 13-benzyl ester 9-tert-butyl ester

CAS Number:

1251007-50-7

Molecular Formula:

C24H33N3O5

Molecular Weight:

443.5359

MDL Number:

MFCD14581295

IUPAC Name:

13-O-benzyl 9-O-tert-butyl 4-oxo-3,9,13-triazadispiro[4.0.56.35]tetradecane-9,13-dicarboxylate

InChI:

InChI=1S/C24H33N3O5/c1-22(2,3)32-21(30)26-13-10-23(11-14-26)16-27(17-24(23)9-12-25-19(24)28)20(29)31-15-18-7-5-4-6-8-18/h4-8H,9-17H2,1-3H3,(H,25,28)

InChI Key:

FMDMPFOHZCSKAV-UHFFFAOYSA-N

SMILES:

O=C(N1CC2(C3(C1)CCN(CC3)C(=O)OC(C)(C)C)CCNC2=O)OCc1ccccc1

Complexity:

734

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

443.242g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

443.544g/mol

Monoisotopic Mass:

443.242g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

88.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.1