3-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-6-ethyl[1,2]thiazolo[4,3-d]pyrimidine-5,7(4H,6H)-dione
Chemical Structure Depiction of
3-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-6-ethyl[1,2]thiazolo[4,3-d]pyrimidine-5,7(4H,6H)-dione
3-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-6-ethyl[1,2]thiazolo[4,3-d]pyrimidine-5,7(4H,6H)-dione
Compound characteristics
| Compound ID: | P422-0223 |
| Compound Name: | 3-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-6-ethyl[1,2]thiazolo[4,3-d]pyrimidine-5,7(4H,6H)-dione |
| Molecular Weight: | 356.4 |
| Molecular Formula: | C17 H16 N4 O3 S |
| Smiles: | CCN1C(c2c(c(C(N3CCc4ccccc4C3)=O)sn2)NC1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9012 |
| logD: | 1.4464 |
| logSw: | -2.4421 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.887 |
| InChI Key: | XBKYBTHYZQYPEY-UHFFFAOYSA-N |