N-(3-{(butan-2-yl)[(furan-2-yl)methyl]amino}propyl)-1-methyl-5,5-dioxo-4,5-dihydro-1H-5lambda~6~-[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Chemical Structure Depiction of
N-(3-{(butan-2-yl)[(furan-2-yl)methyl]amino}propyl)-1-methyl-5,5-dioxo-4,5-dihydro-1H-5lambda~6~-[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
N-(3-{(butan-2-yl)[(furan-2-yl)methyl]amino}propyl)-1-methyl-5,5-dioxo-4,5-dihydro-1H-5lambda~6~-[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | E207-1570 |
| Compound Name: | N-(3-{(butan-2-yl)[(furan-2-yl)methyl]amino}propyl)-1-methyl-5,5-dioxo-4,5-dihydro-1H-5lambda~6~-[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide |
| Molecular Weight: | 470.59 |
| Molecular Formula: | C24 H30 N4 O4 S |
| Smiles: | CCC(C)N(CCCNC(c1c2CS(c3ccccc3c2n(C)n1)(=O)=O)=O)Cc1ccco1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5041 |
| logD: | 1.0379 |
| logSw: | -2.9247 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.272 |
| InChI Key: | BWLSMDYMCIHUHF-KRWDZBQOSA-N |