4-(3,4,5-trimethoxyphenyl)-3,4,5,6-tetrahydrobenzo[h]quinazoline-2(1H)-thione
Chemical Structure Depiction of
4-(3,4,5-trimethoxyphenyl)-3,4,5,6-tetrahydrobenzo[h]quinazoline-2(1H)-thione
4-(3,4,5-trimethoxyphenyl)-3,4,5,6-tetrahydrobenzo[h]quinazoline-2(1H)-thione
Compound characteristics
| Compound ID: | 5701-2333 |
| Compound Name: | 4-(3,4,5-trimethoxyphenyl)-3,4,5,6-tetrahydrobenzo[h]quinazoline-2(1H)-thione |
| Molecular Weight: | 382.48 |
| Molecular Formula: | C21 H22 N2 O3 S |
| Smiles: | COc1cc(cc(c1OC)OC)C1C2CCc3ccccc3C=2NC(N1)=S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7311 |
| logD: | 3.731 |
| logSw: | -4.0615 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 45.858 |
| InChI Key: | JJPUCOHGYRJTDI-SFHVURJKSA-N |