General Information of the Compound
| Compound ID |
CP0216456
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| Compound Name |
(Z)-ethyl 2-(2-isopropylphenylimino)-5,5-dimethyl-1,3-thiazinane-3-carboxylate
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| Formula |
C18H26N2O2S
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| Molecular Weight |
334.485
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| Canonical SMILES |
CCOC(=O)N1CC(C)(C)CS\C1=N/c1ccccc1C(C)C
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| InChI |
InChI=1S/C18H26N2O2S/c1-6-22-17(21)20-11-18(4,5)12-23-16(20)19-15-10-8-7-9-14(15)13(2)3/h7-10,13H,6,11-12H2,1-5H3/b19-16-
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| InChIKey |
RQJGPNVEXHNLIT-MNDPQUGUSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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