Name: Name:rac-tert-butyl (3aR,6aS)-2-oxo-3-(piperidin-4-yl)-hexahydro-2H-pyrrolo[3,4-d][1,3]oxazole-5-carboxylate
Brand: Angene
SKU: AG01BVEP
Rating: 90 (10 reviews)

rac-tert-butyl (3aR,6aS)-2-oxo-3-(piperidin-4-yl)-hexahydro-2H-pyrrolo[3,4-d][1,3]oxazole-5-carboxylate

CAS No.:

2044706-30-9

Catalog Number:

AG01BVEP

Molecular Formula:

C15H25N3O4

Molecular Weight:

311.3767

Catalog Number:

AG01BVEP

Chemical Name:

rac-tert-butyl (3aR,6aS)-2-oxo-3-(piperidin-4-yl)-hexahydro-2H-pyrrolo[3,4-d][1,3]oxazole-5-carboxylate

CAS Number:

2044706-30-9

Molecular Formula:

C15H25N3O4

Molecular Weight:

311.3767

MDL Number:

MFCD30478146

IUPAC Name:

tert-butyl (3aR,6aS)-2-oxo-3-piperidin-4-yl-3a,4,6,6a-tetrahydropyrrolo[3,4-d][1,3]oxazole-5-carboxylate

InChI:

InChI=1S/C15H25N3O4/c1-15(2,3)22-13(19)17-8-11-12(9-17)21-14(20)18(11)10-4-6-16-7-5-10/h10-12,16H,4-9H2,1-3H3/t11-,12+/m1/s1

InChI Key:

LWYTVYRBKASNOF-NEPJUHHUSA-N

SMILES:

O=C(N1C[C@H]2[C@@H](C1)N(C(=O)O2)C1CCNCC1)OC(C)(C)C

Complexity:

456

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

311.185g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

311.382g/mol

Monoisotopic Mass:

311.185g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

71.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.8