Name: Name:tert-butyl 4-(4-ethyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)piperidine-1-carboxylate
Brand: Angene
SKU: AG019ZZM
Rating: 90 (10 reviews)

tert-butyl 4-(4-ethyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)piperidine-1-carboxylate

CAS No.:

1394042-63-7

Catalog Number:

AG019ZZM

Molecular Formula:

C14H24N4O3

Molecular Weight:

296.3654

Catalog Number:

AG019ZZM

Chemical Name:

tert-butyl 4-(4-ethyl-5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)piperidine-1-carboxylate

CAS Number:

1394042-63-7

Molecular Formula:

C14H24N4O3

Molecular Weight:

296.3654

MDL Number:

MFCD22375389

IUPAC Name:

tert-butyl 4-(4-ethyl-5-oxo-1H-1,2,4-triazol-3-yl)piperidine-1-carboxylate

InChI:

InChI=1S/C14H24N4O3/c1-5-18-11(15-16-12(18)19)10-6-8-17(9-7-10)13(20)21-14(2,3)4/h10H,5-9H2,1-4H3,(H,16,19)

InChI Key:

LLWYPYFHROQBDP-UHFFFAOYSA-N

SMILES:

CCn1c(=O)[nH]nc1C1CCN(CC1)C(=O)OC(C)(C)C

Complexity:

448

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

296.185g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

296.371g/mol

Monoisotopic Mass:

296.185g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

74.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.1