3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2,3,6,7,8,9-hexahydro-5H-[1]benzothieno[2,3-d][1,3]thiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2,3,6,7,8,9-hexahydro-5H-[1]benzothieno[2,3-d][1,3]thiazolo[3,2-a]pyrimidin-5-one
3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2,3,6,7,8,9-hexahydro-5H-[1]benzothieno[2,3-d][1,3]thiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | 8012-8730 |
| Compound Name: | 3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2,3,6,7,8,9-hexahydro-5H-[1]benzothieno[2,3-d][1,3]thiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 420.93 |
| Molecular Formula: | C19 H17 Cl N2 O3 S2 |
| Smiles: | COc1cc(cc(c1O)[Cl])C1CSC2=Nc3c(C(N12)=O)c1CCCCc1s3 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5541 |
| logD: | 4.4824 |
| logSw: | -4.5475 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.722 |
| InChI Key: | QQPNMXAWRRCGJD-LBPRGKRZSA-N |