Methyl (2-{(R)-(3-Chlorophenyl)[(3R)-1-({(2S)-1-(Methylamino)-3-[(3R)-Tetrahydro-2H-Pyran-3-Yl]-2-Propanyl}Carbamoyl)-3-Piperidinyl]Methoxy}Ethyl)Carbamate

Molecule SVG Image

Properties Simple | Detailed

Formula C26H41ClN4O5
IUPAC Name methyl n-[2-[(r)-(3-chlorophenyl)-[(3r)-1-[[(1s)-1-(methylaminomethyl)-2-[(3r)-tetrahydropyran-3-yl]ethyl]carbamoyl]-3-piperidyl]methoxy]ethyl]carbamate
Molecular Mass 525.081 g·mol−1
Heat of Formation -990.5 ± 16.7 kJ·mol−1
Dipole Moment 7.48 ± 1.08 D
Volume 651.39 Å 3
Surface Area 490.25 Å 2
HOMO Energy -8.60 ± 0.55 eV
LUMO Energy -0.13 ± eV
Point Group Symmetry C1
InChIKey GCNDDOJRCKHYLZ-ZXMXYHOLSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C Cl O N