C21H21N5O2S
(Z)-1-(4-methoxyphenyl)-N-(10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-4-ylmethoxy)ethanimine
Also Known As: SR-01000114391-1|(1Z)-1-(4-methoxyphenyl)-N-(8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-ylmethoxy)ethanimine|(Z)-1-(4-methoxyphenyl)ethanone O-((8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)methyl) oxime
| Molecular Formula | C21H21N5O2S |
|---|---|
| Molecular Weight | 407.1416 g/mol |
| LogP | 4.1672 |
| Topological Polar Surface Area | 73.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 407.1416 |
| Monoisotopic Mass | 407.1416 |
| Heavy Atoms | 29 |
| Complexity | 1209.4937 |
Chemical Identifiers
| CAS Number | 586997-58-2 |
|---|---|
| SMILES | C/C(=N/OCC1=NN2C=NC3=C(C2=N1)C4=C(S3)CCCC4)/C5=CC=C(C=C5)OC |
Product Overview
C21H21N5O2S (CAS 586997-58-2), with molecular formula C21H21N5O2S and molecular weight 407.1416 g/mol. IUPAC: (Z)-1-(4-methoxyphenyl)-N-(10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-4-ylmethoxy)ethanimine.
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