Name: Name:tert-butyl N-[2-(5-phenyl-4H-1,2,4-triazol-3-yl)ethyl]carbamate
Brand: Angene
SKU: AG01A71K
Rating: 90 (10 reviews)

tert-butyl N-[2-(5-phenyl-4H-1,2,4-triazol-3-yl)ethyl]carbamate

CAS No.:

1461715-14-9

Catalog Number:

AG01A71K

Molecular Formula:

C15H20N4O2

Molecular Weight:

288.3449

Catalog Number:

AG01A71K

Chemical Name:

tert-butyl N-[2-(5-phenyl-4H-1,2,4-triazol-3-yl)ethyl]carbamate

CAS Number:

1461715-14-9

Molecular Formula:

C15H20N4O2

Molecular Weight:

288.3449

MDL Number:

MFCD25970503

IUPAC Name:

tert-butyl N-[2-(3-phenyl-1H-1,2,4-triazol-5-yl)ethyl]carbamate

InChI:

InChI=1S/C15H20N4O2/c1-15(2,3)21-14(20)16-10-9-12-17-13(19-18-12)11-7-5-4-6-8-11/h4-8H,9-10H2,1-3H3,(H,16,20)(H,17,18,19)

InChI Key:

IGSHGUKKMDJLTO-UHFFFAOYSA-N

SMILES:

O=C(OC(C)(C)C)NCCc1nnc([nH]1)c1ccccc1

Complexity:

337

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

288.159g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

288.351g/mol

Monoisotopic Mass:

288.159g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

79.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.6