4-methyl-N-{2-[(pyrimidin-2-yl)sulfanyl]-1,2-dihydroacenaphthylen-1-yl}benzene-1-sulfonamide
Chemical Structure Depiction of
4-methyl-N-{2-[(pyrimidin-2-yl)sulfanyl]-1,2-dihydroacenaphthylen-1-yl}benzene-1-sulfonamide
4-methyl-N-{2-[(pyrimidin-2-yl)sulfanyl]-1,2-dihydroacenaphthylen-1-yl}benzene-1-sulfonamide
Compound characteristics
| Compound ID: | 5227-6181 |
| Compound Name: | 4-methyl-N-{2-[(pyrimidin-2-yl)sulfanyl]-1,2-dihydroacenaphthylen-1-yl}benzene-1-sulfonamide |
| Molecular Weight: | 433.55 |
| Molecular Formula: | C23 H19 N3 O2 S2 |
| Smiles: | Cc1ccc(cc1)S(NC1C(c2cccc3cccc1c23)Sc1ncccn1)(=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.1164 |
| logD: | 5.114 |
| logSw: | -5.5352 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.424 |
| InChI Key: | OITMRGUQXMGHLC-UHFFFAOYSA-N |