N-{2-[5-(3,4-dimethoxyphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-methyl-N'-(propan-2-yl)urea
Chemical Structure Depiction of
N-{2-[5-(3,4-dimethoxyphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-methyl-N'-(propan-2-yl)urea
N-{2-[5-(3,4-dimethoxyphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-methyl-N'-(propan-2-yl)urea
Compound characteristics
| Compound ID: | V014-0209 |
| Compound Name: | N-{2-[5-(3,4-dimethoxyphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-methyl-N'-(propan-2-yl)urea |
| Molecular Weight: | 444.55 |
| Molecular Formula: | C22 H28 N4 O4 S |
| Smiles: | CC(C)NC(N(C)CC(N1C(CC(c2cccs2)=N1)c1ccc(c(c1)OC)OC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1752 |
| logD: | 3.1752 |
| logSw: | -3.4226 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.677 |
| InChI Key: | ZWELWPDXZFBUMW-QGZVFWFLSA-N |