N-[2-(cyclohex-1-en-1-yl)ethyl]-4-{[2-(4-methoxyphenyl)-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl]methyl}benzamide
Chemical Structure Depiction of
N-[2-(cyclohex-1-en-1-yl)ethyl]-4-{[2-(4-methoxyphenyl)-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl]methyl}benzamide
N-[2-(cyclohex-1-en-1-yl)ethyl]-4-{[2-(4-methoxyphenyl)-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl]methyl}benzamide
Compound characteristics
| Compound ID: | E856-3091 |
| Compound Name: | N-[2-(cyclohex-1-en-1-yl)ethyl]-4-{[2-(4-methoxyphenyl)-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl]methyl}benzamide |
| Molecular Weight: | 484.6 |
| Molecular Formula: | C29 H32 N4 O3 |
| Smiles: | COc1ccc(cc1)c1cc2N(Cc3ccc(cc3)C(NCCC3CCCCC=3)=O)C(CCn2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7059 |
| logD: | 4.7059 |
| logSw: | -4.2756 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.011 |
| InChI Key: | WTISMPURKOZMCK-UHFFFAOYSA-N |