N'-butyl-N-(5,5-dimethyl-3-{[3-(5-nitrofuran-2-yl)prop-2-en-1-ylidene]amino}-2-sulfanylidene-1,3-thiazolidin-4-yl)-N-hydroxyurea
Chemical Structure Depiction of
N'-butyl-N-(5,5-dimethyl-3-{[3-(5-nitrofuran-2-yl)prop-2-en-1-ylidene]amino}-2-sulfanylidene-1,3-thiazolidin-4-yl)-N-hydroxyurea
N'-butyl-N-(5,5-dimethyl-3-{[3-(5-nitrofuran-2-yl)prop-2-en-1-ylidene]amino}-2-sulfanylidene-1,3-thiazolidin-4-yl)-N-hydroxyurea
Compound characteristics
| Compound ID: | 8005-2724 |
| Compound Name: | N'-butyl-N-(5,5-dimethyl-3-{[3-(5-nitrofuran-2-yl)prop-2-en-1-ylidene]amino}-2-sulfanylidene-1,3-thiazolidin-4-yl)-N-hydroxyurea |
| Molecular Weight: | 441.53 |
| Molecular Formula: | C17 H23 N5 O5 S2 |
| Smiles: | CCCCNC(N(C1C(C)(C)SC(N1/N=C/C=C/c1ccc([N+]([O-])=O)o1)=S)O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6216 |
| logD: | 3.6172 |
| logSw: | -3.6977 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 102.23 |
| InChI Key: | PBTBFOWOYBXYSB-AWEZNQCLSA-N |