4,4,9-trimethyl-6-{[(pyrimidin-2-yl)sulfanyl]methyl}-4H-pyrrolo[3,2,1-ij]quinoline-1,2-dione
Chemical Structure Depiction of
4,4,9-trimethyl-6-{[(pyrimidin-2-yl)sulfanyl]methyl}-4H-pyrrolo[3,2,1-ij]quinoline-1,2-dione
4,4,9-trimethyl-6-{[(pyrimidin-2-yl)sulfanyl]methyl}-4H-pyrrolo[3,2,1-ij]quinoline-1,2-dione
Compound characteristics
| Compound ID: | Y021-2393 |
| Compound Name: | 4,4,9-trimethyl-6-{[(pyrimidin-2-yl)sulfanyl]methyl}-4H-pyrrolo[3,2,1-ij]quinoline-1,2-dione |
| Molecular Weight: | 351.43 |
| Molecular Formula: | C19 H17 N3 O2 S |
| Smiles: | Cc1ccc2C(CSc3ncccn3)=CC(C)(C)N3C(C(c1c23)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0437 |
| logD: | 3.0437 |
| logSw: | -3.3253 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.725 |
| InChI Key: | SMDRFOWUWZJTTP-UHFFFAOYSA-N |