(4S)-4-[(1R)-1-Hydroxy-2-{[1-(3-Isopropylphenyl)Cyclopropyl]Amino}Ethyl]-19-(Methoxymethyl)-11-Oxa-3,16-Diazatricyclo[15.3.1.1~6,10~]Docosa-1(21),6(22),7,9,17,19-Hexaen-2-One
Properties
Property | Value |
---|---|
Formula | C35H45N3O4 |
IUPAC Name | (4s)-4-[(1r)-1-hydroxy-2-[[1-(3-isopropylphenyl)cyclopropyl]amino]ethyl]-19-(methoxymethyl)-11-oxa-3,16-diazatricyclo[15.3.1.16,10]docosa-1(21),6(22),7,9,17,19-hexaen-2-one |
Molecular Mass | 571.749 g·mol−1 |
Heat of Formation | -467.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.01 ± 1.08 D |
Volume | 735.03 Å 3 |
Surface Area | 565.33 Å 2 |
HOMO Energy | -8.52 ± 0.55 eV |
LUMO Energy | 2.86 ± eV |
Point Group Symmetry | C1 |
InChIKey | GCZHKZTYTMTFGU-JHOUSYSJSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |