7-(3-((2-(3,4-DIHYDROXYPHENYL)-2-HYDROXYETHYL)AMINO)BUTYL)THEOPHYLLINE

CAS No.
62401-91-6
CCD No.
CCD00239737
Formula
C19 H25 N5 O5
MolWeight
403.436

Basic Information

Product Name: 7-(3-((2-(3,4-DIHYDROXYPHENYL)-2-HYDROXYETHYL)AMINO)BUTYL)THEOPHYLLINE
CAS: 62401-91-6
English Synonyms: 7-(3-((2-(3,4-DIHYDROXYPHENYL)-2-HYDROXYETHYL)AMINO)BUTYL)THEOPHYLLINE
MDL Number.: MFCD01682272
H bond acceptor: 10
H bond donor: 4
Smile: CC(CCn1cnc2c1c(=O)n(c(=O)n2C)C)NCC(c3ccc(c(c3)O)O)O
InChi: InChI=1S/C19H25N5O5/c1-11(20-9-15(27)12-4-5-13(25)14(26)8-12)6-7-24-10-21-17-16(24)18(28)23(3)19(29)22(17)2/h4-5,8,10-11,15,20,25-27H,6-7,9H2,1-3H3
InChiKey: InChIKey=CJEOBARKFDOSRV-UHFFFAOYSA-N

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