N-(2-{cyclopentyl[(furan-2-yl)methyl]amino}ethyl)-1-methyl-5,5-dioxo-4,5-dihydro-1H-5lambda~6~-[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Chemical Structure Depiction of
N-(2-{cyclopentyl[(furan-2-yl)methyl]amino}ethyl)-1-methyl-5,5-dioxo-4,5-dihydro-1H-5lambda~6~-[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
N-(2-{cyclopentyl[(furan-2-yl)methyl]amino}ethyl)-1-methyl-5,5-dioxo-4,5-dihydro-1H-5lambda~6~-[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | E207-1567 |
| Compound Name: | N-(2-{cyclopentyl[(furan-2-yl)methyl]amino}ethyl)-1-methyl-5,5-dioxo-4,5-dihydro-1H-5lambda~6~-[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide |
| Molecular Weight: | 468.57 |
| Molecular Formula: | C24 H28 N4 O4 S |
| Smiles: | Cn1c2c3ccccc3S(Cc2c(C(NCCN(Cc2ccco2)C2CCCC2)=O)n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1914 |
| logD: | 1.9013 |
| logSw: | -2.9092 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.283 |
| InChI Key: | FMLNFYUUMQOJCI-UHFFFAOYSA-N |