| SpectraBase Spectrum ID |
Dg1CWeNp1pv |
| Name |
(2R,3R)-2-(2,4-difluorophenyl)-3-(4-(quinolin-2-yl)-1,4-diazepan-1-yl)-1-(1H-1,2,4-triazol-1-yl)butan-2-ol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C26H28F2N6O |
| InChI |
InChI=1S/C26H28F2N6O/c1-19(26(35,16-34-18-29-17-30-34)22-9-8-21(27)15-23(22)28)32-11-4-12-33(14-13-32)25-10-7-20-5-2-3-6-24(20)31-25/h2-3,5-10,15,17-19,35H,4,11-14,16H2,1H3/t19-,26-/m1/s1 |
| InChIKey |
PKHWUQIEHHGNHV-NIYFSFCBSA-N |
| Ionization Type |
EI |
| Molecular Weight |
478.548 g/mol |
| SMILES |
O[C@@](c1ccc(cc1F)F)([C@](N1CCCN(CC1)c1ccc2c(n1)cccc2)(C)[H])C[n]1ncnc1 |
| SPLASH |
splash10-0udi-0390000000-f0d0eebdfcb8b297a250 |
| Source of Spectrum |
US20100144712A1 |
| Wiley ID |
1842385 |
