3-methyl-5-({1-[(2-nitrophenyl)methyl]-1H-pyrrol-2-yl}methylidene)-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
3-methyl-5-({1-[(2-nitrophenyl)methyl]-1H-pyrrol-2-yl}methylidene)-2-sulfanylidene-1,3-thiazolidin-4-one
3-methyl-5-({1-[(2-nitrophenyl)methyl]-1H-pyrrol-2-yl}methylidene)-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 4490-1887 |
| Compound Name: | 3-methyl-5-({1-[(2-nitrophenyl)methyl]-1H-pyrrol-2-yl}methylidene)-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 359.42 |
| Molecular Formula: | C16 H13 N3 O3 S2 |
| Smiles: | CN1C(/C(=C\c2cccn2Cc2ccccc2[N+]([O-])=O)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3463 |
| logD: | 3.3463 |
| logSw: | -3.7173 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 51.631 |
| InChI Key: | NIXIJRCQBKBTGU-UHFFFAOYSA-N |