1-{4-[3-methyl-1-(3-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-(3-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-(3-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: | Z301-0578 |
| Compound Name: | 1-{4-[3-methyl-1-(3-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: | Cc1cccc(CC(N2CCCN(CC2)c2nc3c(c(C)nn3c3cccc(C)c3)s2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.6259 |
| logD: | 5.6259 |
| logSw: | -5.325 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 44.551 |
| InChI Key: | KKUZCKZXDJZTLF-UHFFFAOYSA-N |