4-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-6-propyl-2-(pyrrolidin-1-yl)[1,3]thiazolo[4,5-d]pyrimidine-5,7(4H,6H)-dione
Chemical Structure Depiction of
4-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-6-propyl-2-(pyrrolidin-1-yl)[1,3]thiazolo[4,5-d]pyrimidine-5,7(4H,6H)-dione
4-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-6-propyl-2-(pyrrolidin-1-yl)[1,3]thiazolo[4,5-d]pyrimidine-5,7(4H,6H)-dione
Compound characteristics
| Compound ID: | L862-0255 |
| Compound Name: | 4-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-6-propyl-2-(pyrrolidin-1-yl)[1,3]thiazolo[4,5-d]pyrimidine-5,7(4H,6H)-dione |
| Molecular Weight: | 453.56 |
| Molecular Formula: | C23 H27 N5 O3 S |
| Smiles: | CCCN1C(c2c(nc(N3CCCC3)s2)N(CC(N2CCc3ccccc3C2)=O)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9238 |
| logD: | 3.9238 |
| logSw: | -3.7279 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 62.493 |
| InChI Key: | HZRVGCOJFNTIFN-UHFFFAOYSA-N |