6,8,8,9-tetramethyl-3-{[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]acetyl}-8,9-dihydro-2H-pyrano[3,2-g]quinolin-2-one
Chemical Structure Depiction of
6,8,8,9-tetramethyl-3-{[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]acetyl}-8,9-dihydro-2H-pyrano[3,2-g]quinolin-2-one
6,8,8,9-tetramethyl-3-{[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]acetyl}-8,9-dihydro-2H-pyrano[3,2-g]quinolin-2-one
Compound characteristics
| Compound ID: | Y021-2441 |
| Compound Name: | 6,8,8,9-tetramethyl-3-{[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]acetyl}-8,9-dihydro-2H-pyrano[3,2-g]quinolin-2-one |
| Molecular Weight: | 473.55 |
| Molecular Formula: | C25 H23 N5 O3 S |
| Smiles: | CC1=CC(C)(C)N(C)c2cc3c(C=C(C(CSc4nnnn4c4ccccc4)=O)C(=O)O3)cc12 |
| Stereo: | ACHIRAL |
| logP: | 4.5053 |
| logD: | 4.5053 |
| logSw: | -4.4603 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 75.596 |
| InChI Key: | PRSKUTWOCMMVEG-UHFFFAOYSA-N |