7-(3-((2-(3,5-DIHYDROXYPHENYL)-2-HYDROXYETHYL)AMINO)-2-METHYLPROPYL)THEOPHYLLINE

CAS No.
62401-88-1
CCD No.
CCD00239742
Formula
C19 H25 N5 O5
MolWeight
403.436

Basic Information

Product Name: 7-(3-((2-(3,5-DIHYDROXYPHENYL)-2-HYDROXYETHYL)AMINO)-2-METHYLPROPYL)THEOPHYLLINE
CAS: 62401-88-1
English Synonyms: 7-(3-((2-(3,5-DIHYDROXYPHENYL)-2-HYDROXYETHYL)AMINO)-2-METHYLPROPYL)THEOPHYLLINE
MDL Number.: MFCD01682277
H bond acceptor: 10
H bond donor: 4
Smile: CC(CNCC(c1cc(cc(c1)O)O)O)Cn2cnc3c2c(=O)n(c(=O)n3C)C
InChi: InChI=1S/C19H25N5O5/c1-11(7-20-8-15(27)12-4-13(25)6-14(26)5-12)9-24-10-21-17-16(24)18(28)23(3)19(29)22(17)2/h4-6,10-11,15,20,25-27H,7-9H2,1-3H3
InChiKey: InChIKey=PHVYSYOGPWMPTC-UHFFFAOYSA-N

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