Name: Name:1-Pyrrolidinecarboxylic acid, 2-[(5-phenyl-1,3,4-oxadiazol-2-yl)Methyl]-, 1,1-diMethylethyl ester, (2S)-
Brand: Angene
SKU: AG00DB2Z
Rating: 90 (10 reviews)

1-Pyrrolidinecarboxylic acid, 2-[(5-phenyl-1,3,4-oxadiazol-2-yl)Methyl]-, 1,1-diMethylethyl ester, (2S)-

CAS No.:

483314-82-5

Catalog Number:

AG00DB2Z

Molecular Formula:

C18H23N3O3

Molecular Weight:

329.3935

Catalog Number:

AG00DB2Z

Chemical Name:

1-Pyrrolidinecarboxylic acid, 2-[(5-phenyl-1,3,4-oxadiazol-2-yl)Methyl]-, 1,1-diMethylethyl ester, (2S)-

CAS Number:

483314-82-5

Molecular Formula:

C18H23N3O3

Molecular Weight:

329.3935

MDL Number:

MFCD23160066

IUPAC Name:

tert-butyl (2S)-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]pyrrolidine-1-carboxylate

InChI:

InChI=1S/C18H23N3O3/c1-18(2,3)24-17(22)21-11-7-10-14(21)12-15-19-20-16(23-15)13-8-5-4-6-9-13/h4-6,8-9,14H,7,10-12H2,1-3H3/t14-/m0/s1

InChI Key:

NMQOOJNHFJPYAX-AWEZNQCLSA-N

SMILES:

O=C(N1CCC[C@H]1Cc1nnc(o1)c1ccccc1)OC(C)(C)C

Complexity:

432

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

329.174g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

329.4g/mol

Monoisotopic Mass:

329.174g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

68.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.1