5-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methylidene}-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
5-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methylidene}-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione
5-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methylidene}-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
| Compound ID: | 3679-2229 |
| Compound Name: | 5-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methylidene}-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione |
| Molecular Weight: | 367.47 |
| Molecular Formula: | C20 H21 N3 O2 S |
| Smiles: | Cc1ccc(cc1)n1c(C)cc(C=C2C(N(C)C(N(C)C2=O)=S)=O)c1C |
| Stereo: | ACHIRAL |
| logP: | 2.3295 |
| logD: | 2.3295 |
| logSw: | -2.7442 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 34.483 |
| InChI Key: | SFMYUAKECPGLJX-UHFFFAOYSA-N |