Name: Name:1-Piperazinecarboxylicacid, 3-oxo-4-(phenylmethyl)-, 1,1-dimethylethyl ester
Brand: Angene
SKU: AG008MHP
Rating: 90 (10 reviews)

1-Piperazinecarboxylicacid, 3-oxo-4-(phenylmethyl)-, 1,1-dimethylethyl ester

CAS No.:

78551-60-7

Catalog Number:

AG008MHP

Molecular Formula:

C16H22N2O3

Molecular Weight:

290.3575

Catalog Number:

AG008MHP

Chemical Name:

1-Piperazinecarboxylicacid, 3-oxo-4-(phenylmethyl)-, 1,1-dimethylethyl ester

CAS Number:

78551-60-7

Molecular Formula:

C16H22N2O3

Molecular Weight:

290.3575

MDL Number:

MFCD09028511

IUPAC Name:

tert-butyl 4-benzyl-3-oxopiperazine-1-carboxylate

InChI:

InChI=1S/C16H22N2O3/c1-16(2,3)21-15(20)18-10-9-17(14(19)12-18)11-13-7-5-4-6-8-13/h4-8H,9-12H2,1-3H3

InChI Key:

OTBBDCMPKZSOMD-UHFFFAOYSA-N

SMILES:

O=C1CN(CCN1Cc1ccccc1)C(=O)OC(C)(C)C

Complexity:

384

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

290.163g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

290.363g/mol

Monoisotopic Mass:

290.163g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

49.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.9