3,7-dimethyl-6-[4-(4-nitrophenyl)piperazine-1-sulfonyl]-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
3,7-dimethyl-6-[4-(4-nitrophenyl)piperazine-1-sulfonyl]-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
3,7-dimethyl-6-[4-(4-nitrophenyl)piperazine-1-sulfonyl]-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | C301-5259 |
| Compound Name: | 3,7-dimethyl-6-[4-(4-nitrophenyl)piperazine-1-sulfonyl]-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 449.51 |
| Molecular Formula: | C18 H19 N5 O5 S2 |
| Smiles: | CC1=CSC2=NC(C)=C(C(N12)=O)S(N1CCN(CC1)c1ccc(cc1)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7016 |
| logD: | 1.7016 |
| logSw: | -2.3341 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 93.122 |
| InChI Key: | ZKRPFSGFLDAYEQ-UHFFFAOYSA-N |