1-{4-[3-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d][1,3]thiazol-5-yl]-1,4-diazepan-1-yl}-2-(3-methylphenyl)ethan-1-one
Chemical Structure Depiction of
1-{4-[3-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d][1,3]thiazol-5-yl]-1,4-diazepan-1-yl}-2-(3-methylphenyl)ethan-1-one
1-{4-[3-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d][1,3]thiazol-5-yl]-1,4-diazepan-1-yl}-2-(3-methylphenyl)ethan-1-one
Compound characteristics
| Compound ID: | Z301-0282 |
| Compound Name: | 1-{4-[3-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d][1,3]thiazol-5-yl]-1,4-diazepan-1-yl}-2-(3-methylphenyl)ethan-1-one |
| Molecular Weight: | 459.61 |
| Molecular Formula: | C26 H29 N5 O S |
| Smiles: | Cc1ccc(cc1)n1c2c(c(C)n1)sc(n2)N1CCCN(CC1)C(Cc1cccc(C)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5559 |
| logD: | 5.5559 |
| logSw: | -5.2663 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 44.551 |
| InChI Key: | SSPBOZJNSWERED-UHFFFAOYSA-N |