N-(2-{butyl[(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-{butyl[(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-{butyl[(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: | E207-1571 |
| Compound Name: | N-(2-{butyl[(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: | 456.56 |
| Molecular Formula: | C23 H28 N4 O4 S |
| Smiles: | CCCCN(CCNC(c1c2CS(c3ccccc3c2n(C)n1)(=O)=O)=O)Cc1ccco1 |
| Stereo: | ACHIRAL |
| logP: | 2.4956 |
| logD: | 2.3062 |
| logSw: | -3.009 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.031 |
| InChI Key: | VYAIHUVETMFIPD-UHFFFAOYSA-N |