3-[(6-benzyl-5-methyl-3,7-dioxo-7H-[1,3]thiazolo[3,2-a]pyrimidin-2(3H)-ylidene)methyl]phenyl acetate
Chemical Structure Depiction of
3-[(6-benzyl-5-methyl-3,7-dioxo-7H-[1,3]thiazolo[3,2-a]pyrimidin-2(3H)-ylidene)methyl]phenyl acetate
3-[(6-benzyl-5-methyl-3,7-dioxo-7H-[1,3]thiazolo[3,2-a]pyrimidin-2(3H)-ylidene)methyl]phenyl acetate
Compound characteristics
| Compound ID: | Y070-4302 |
| Compound Name: | 3-[(6-benzyl-5-methyl-3,7-dioxo-7H-[1,3]thiazolo[3,2-a]pyrimidin-2(3H)-ylidene)methyl]phenyl acetate |
| Molecular Weight: | 418.47 |
| Molecular Formula: | C23 H18 N2 O4 S |
| Smiles: | CC1=C(Cc2ccccc2)C(N=C2N1C(/C(=C\c1cccc(c1)OC(C)=O)S2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9155 |
| logD: | 2.9155 |
| logSw: | -3.3414 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 59.535 |
| InChI Key: | UKJWROKTNBTIHZ-UHFFFAOYSA-N |