6-butyl-3-[4-(pyrimidin-2-yl)piperazine-1-carbonyl][1,2]thiazolo[4,3-d]pyrimidine-5,7(4H,6H)-dione
Chemical Structure Depiction of
6-butyl-3-[4-(pyrimidin-2-yl)piperazine-1-carbonyl][1,2]thiazolo[4,3-d]pyrimidine-5,7(4H,6H)-dione
6-butyl-3-[4-(pyrimidin-2-yl)piperazine-1-carbonyl][1,2]thiazolo[4,3-d]pyrimidine-5,7(4H,6H)-dione
Compound characteristics
| Compound ID: | P422-0764 |
| Compound Name: | 6-butyl-3-[4-(pyrimidin-2-yl)piperazine-1-carbonyl][1,2]thiazolo[4,3-d]pyrimidine-5,7(4H,6H)-dione |
| Molecular Weight: | 415.47 |
| Molecular Formula: | C18 H21 N7 O3 S |
| Smiles: | CCCCN1C(c2c(c(C(N3CCN(CC3)c3ncccn3)=O)sn2)NC1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8622 |
| logD: | 1.224 |
| logSw: | -2.5386 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.102 |
| InChI Key: | WIRAYQDPRPNRKR-UHFFFAOYSA-N |