AC1NIOWA
14-(3-chlorophenyl)-15-hydrazinyl-4,4,8-trimethyl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1,7,9,12(17),15-pentaen-13-one
Also Known As: 9-(3-chlorophenyl)-10-hydrazinyl-2,2,5-trimethyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8(9H)-one|9-(3-chlorophenyl)-10-hydrazinyl-2,2,5-trimethyl-4,9-dihydro-1H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8(2H)-one
| Molecular Formula | C21H20ClN5O2S |
|---|---|
| Molecular Weight | 441.10263 g/mol |
| LogP | 4.09412 |
| Topological Polar Surface Area | 95.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 441.10263 |
| Monoisotopic Mass | 441.10263 |
| Heavy Atoms | 30 |
| Complexity | 1392.1726 |
Chemical Identifiers
| CAS Number | 896068-69-2 |
|---|---|
| SMILES | CC1=C2COC(CC2=C3C4=C(C(=O)N(C(=N4)NN)C5=CC(=CC=C5)Cl)SC3=N1)(C)C |
Product Overview
AC1NIOWA (CAS 896068-69-2), with molecular formula C21H20ClN5O2S and molecular weight 441.10263 g/mol. IUPAC: 14-(3-chlorophenyl)-15-hydrazinyl-4,4,8-trimethyl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1,7,9,12(17),15-pentaen-13-one.
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