(azepan-1-yl)(2-{4-[(4-methoxyphenyl)methyl]-3,5-dimethyl-1H-pyrazol-1-yl}-4-methyl-1,3-thiazol-5-yl)methanone
Chemical Structure Depiction of
(azepan-1-yl)(2-{4-[(4-methoxyphenyl)methyl]-3,5-dimethyl-1H-pyrazol-1-yl}-4-methyl-1,3-thiazol-5-yl)methanone
(azepan-1-yl)(2-{4-[(4-methoxyphenyl)methyl]-3,5-dimethyl-1H-pyrazol-1-yl}-4-methyl-1,3-thiazol-5-yl)methanone
Compound characteristics
| Compound ID: | D314-0417 |
| Compound Name: | (azepan-1-yl)(2-{4-[(4-methoxyphenyl)methyl]-3,5-dimethyl-1H-pyrazol-1-yl}-4-methyl-1,3-thiazol-5-yl)methanone |
| Molecular Weight: | 438.59 |
| Molecular Formula: | C24 H30 N4 O2 S |
| Smiles: | Cc1c(C(N2CCCCCC2)=O)sc(n1)n1c(C)c(Cc2ccc(cc2)OC)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.8354 |
| logD: | 4.7823 |
| logSw: | -4.5882 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.305 |
| InChI Key: | YRBPHEKKCKWZBJ-UHFFFAOYSA-N |