DARUNAVIR ,635728-49-3 _Chemical Cloud Database

DARUNAVIR

Basic Information
Product Name：	DARUNAVIR
CAS：	635728-49-3 ;206361-99-1
English Synonyms：	[(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](2-METHYLPROPYL)AMINO]-2-HYDROXY-1-(PHENYL-METHYL)PROPYL]CARABAMIC ACID (3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]-FURAN-3-YL ESTER ; TMC-114 ; DARUNAVIR (ETHANOLATE) ; DARUNAVIR ETHANOLATE ; DARUNAVIR ; DARUNAVIR BASE
MDL Number.：	MFCD09260006
H bond acceptor：	10
H bond donor：	3
Smile：	CC(C)CN(C[C@H]([C@H](Cc1ccccc1)NC(=O)O[C@H]2CO[C@@H]3[C@H]2CCO3)O)S(=O)(=O)c4ccc(cc4)N
InChi：	InChI=1S/C27H37N3O7S/c1-18(2)15-30(38(33,34)21-10-8-20(28)9-11-21)16-24(31)23(14-19-6-4-3-5-7-19)29-27(32)37-25-17-36-26-22(25)12-13-35-26/h3-11,18,22-26,31H,12-17,28H2,1-2H3,(H,29,32)/t22-,23-,24+,25-,26+/m0/s1
InChiKey：	InChIKey=CJBJHOAVZSMMDJ-HEXNFIEUSA-N
Property
Melting Point：	74-76 DEG C
Comments：	APPEARANCE: WHITE TO OFF-WHITE POWDER
Safety information

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