7-[(1,3-benzothiazol-2-yl)sulfanyl]-3-benzyl-5-methyl[1,3]thiazolo[4,5-d]pyrimidine-2(3H)-thione
Chemical Structure Depiction of
7-[(1,3-benzothiazol-2-yl)sulfanyl]-3-benzyl-5-methyl[1,3]thiazolo[4,5-d]pyrimidine-2(3H)-thione
7-[(1,3-benzothiazol-2-yl)sulfanyl]-3-benzyl-5-methyl[1,3]thiazolo[4,5-d]pyrimidine-2(3H)-thione
Compound characteristics
| Compound ID: | 8017-2295 |
| Compound Name: | 7-[(1,3-benzothiazol-2-yl)sulfanyl]-3-benzyl-5-methyl[1,3]thiazolo[4,5-d]pyrimidine-2(3H)-thione |
| Molecular Weight: | 438.61 |
| Molecular Formula: | C20 H14 N4 S4 |
| Smiles: | Cc1nc2c(c(n1)Sc1nc3ccccc3s1)SC(N2Cc1ccccc1)=S |
| Stereo: | ACHIRAL |
| logP: | 6.5469 |
| logD: | 6.5469 |
| logSw: | -5.9644 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 31.0666 |
| InChI Key: | DKNUBFYPNFTOJG-UHFFFAOYSA-N |