3-(4-methoxyphenyl)-5-(3,4,5-trimethoxyphenyl)-4,5-dihydro-1H-pyrazole-1-carbothioamide
Chemical Structure Depiction of
3-(4-methoxyphenyl)-5-(3,4,5-trimethoxyphenyl)-4,5-dihydro-1H-pyrazole-1-carbothioamide
3-(4-methoxyphenyl)-5-(3,4,5-trimethoxyphenyl)-4,5-dihydro-1H-pyrazole-1-carbothioamide
Compound characteristics
| Compound ID: | C202-4018 |
| Compound Name: | 3-(4-methoxyphenyl)-5-(3,4,5-trimethoxyphenyl)-4,5-dihydro-1H-pyrazole-1-carbothioamide |
| Molecular Weight: | 401.48 |
| Molecular Formula: | C20 H23 N3 O4 S |
| Smiles: | COc1ccc(cc1)C1CC(c2cc(c(c(c2)OC)OC)OC)N(C(N)=S)N=1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3557 |
| logD: | 3.3557 |
| logSw: | -3.5102 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.221 |
| InChI Key: | VCQQPARUDKSAHZ-INIZCTEOSA-N |