Synonym: 1,5-Anhydro-2,3-dideoxy-4-O-methyl-3-[[(1R,3S)-3-(1-methylethyl)-3-[[(1S,4S)-5-[6-(trifluoromethyl)-4-pyrimidinyl]-2,5-diazabicyclo[2.2.1]hept-2-yl]carbonyl]cyclopentyl]amino]-D-erythro-pentitol succinate; PF 04634817 succinate
CAS Number: 1228111-63-4 (free base)
Empirical Formula (Hill Notation): C25H36F3N5O3 · C4H6O4
Molecular Weight: 629.67
Linear Formula: C25H36F3N5O3 · C4H6O4
Product Type: Chemical
| assay |
≥98% (HPLC) |
| color |
white to beige |
| form |
powder |
| InChI |
1S/C25H36F3N5O3.C4H6O4/c1-15(2)24(6-4-16(10-24)31-19-5-7-36-13-20(19)35-3)23(34)33-12-17-8-18(33)11-32(17)22-9-21(25(26,27)28)29-14-30-22;5-3(6)1-2-4(7)8/h9,14-20,31H,4-8,10-13H2,1-3H3;1-2H2,(H,5,6)(H,7,8)/t16-,17+,18+,19+,20-,24+;/m1./s1 |
| InChI key |
WRPPUEHVLSHXJG-HTQYHTRRSA-N |
| Quality Level |
100  |
| SMILES string |
CC(C)[C@@]1(C(N2C[C@@]3([H])N(C4=NC=NC(C(F)(F)F)=C4)C[C@]2([H])C3)=O)C[C@H](N[C@H]5CCOC[C@H]5OC)CC1.O=C(CCC(O)=O)O |
| solubility |
H2O: 30 mg/mL, clear |
| storage temp. |
room temp |
| Biochem/physiol Actions: |
PF-04634817 is a potent and selective antagonist of CC chemokine receptor 2 and 5 (CCR2/5). |
| Packaging: |
5, 25 mg in glass bottle |
| RIDADR |
NONH for all modes of transport |
| WGK Germany |
WGK 3 |
| Flash Point(F) |
Not applicable |
| Flash Point(C) |
Not applicable |
| Purity |
≥98% (HPLC) |
| Storage Temp. |
room temp |
| UNSPSC |
51111800 |
