7-BENZYL-8-(2-N,N-DI-N-BUTYLAMINOETHYL)AMINOTHEOPHYLLINE HYDROMALEATE

CAS No.
130187-62-1
CCD No.
CCD00241934
Formula
C24 H36 N6 O2 . C4 H4 O4
MolWeight
556.66

Basic Information

Product Name: 7-BENZYL-8-(2-N,N-DI-N-BUTYLAMINOETHYL)AMINOTHEOPHYLLINE HYDROMALEATE
CAS: 130187-62-1
English Synonyms: 7-BENZYL-8-(2-N,N-DI-N-BUTYLAMINOETHYL)AMINOTHEOPHYLLINE HYDROMALEATE
MDL Number.: MFCD01694352
H bond acceptor: 8
H bond donor: 1
Smile: CCCCN(CCCC)CCNc1nc2c(n1Cc3ccccc3)c(=O)n(c(=O)n2C)C.C(=C\C(=O)O)\C(=O)O
InChi: InChI=1S/C24H36N6O2.C4H4O4/c1-5-7-15-29(16-8-6-2)17-14-25-23-26-21-20(22(31)28(4)24(32)27(21)3)30(23)18-19-12-10-9-11-13-19;5-3(6)1-2-4(7)8/h9-13H,5-8,14-18H2,1-4H3,(H,25,26);1-2H,(H,5,6)(H,7,8)/b;2-1-
InChiKey: InChIKey=OHKJMYCLEVMQKJ-BTJKTKAUSA-N

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