187602-11-5
SOFIGATRAN
Name
SOFIGATRAN
Formula
C24 H44 N4 O4 S
MolWeight
484.702
1Identification
【Name】
SOFIGATRAN
【CAS】
【MDL】
MFCD09954144
【English Synonyms】
【Formula】
C24 H44 N4 O4 S
【MolWeight】
484.702
【Inchi】
InChI=1S/C24H44N4O4S/c1-6-14-32-23(31)27-20(24(4,5)33-16(2)3)22(30)28-13-7-8-19(28)21(29)26-15-17-9-11-18(25)12-10-17/h16-20H,6-15,25H2,1-5H3,(H,26,29)(H,27,31)/t17-,18-,19-,20-/m0/s1
【InChIKey】
InChIKey=MNMZVSQUWOILCZ-MUGJNUQGSA-N
【SMILES】
CCCOC(=O)N[C@@H](C(=O)N1CCC[C@H]1C(=O)NC[C@@H]2CC[C@H](CC2)N)C(C)(C)SC(C)C
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:8
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
SOFIGATRAN.cml
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