13-Oxo-Cobicistat

Product Specifications

CAS Number

2984891-98-5

Hazard Statement

No Data Available

Smiles

O=C(OCC1=CN=CS1)N[C@@H](CC2=CC=CC=C2)CC[C@@H](NC([C@H](CCN3CCOCC3)NC(N(C(C4=CSC(C(C)C)=N4)=O)C)=O)=O)CC5=CC=CC=C5

Molecular Formula

C40H51N7O6S2

Molecular Weight

790.01

InChI

InChI=1S/C40H51N7O6S2/c1-28(2)37-44-35(26-54-37)38(49)46(3)39(50)45-34(16-17-47-18-20-52-21-19-47)36(48)42-31(22-29-10-6-4-7-11-29)14-15-32(23-30-12-8-5-9-13-30)43-40(51)53-25-33-24-41-27-55-33/h4-13,24,26-28,31-32,34H,14-23,25H2,1-3H3,(H,42,48)(H,43,51)(H,45,50)/t31-,32-,34+/m1/s1

Additionnal Information

IUPAC name: thiazol-5-ylmethyl ((2R,5R)-5-((S)-2-(3-(2-isopropylthiazole-4-carbonyl)-3-methylureido)-4-morpholinobutanamido)-1,6-diphenylhexan-2-yl)carbamate