4-({6-[(2-chlorophenyl)methyl]-5-methyl-3,7-dioxo-7H-[1,3]thiazolo[3,2-a]pyrimidin-2(3H)-ylidene}methyl)-2-methoxyphenyl acetate
Chemical Structure Depiction of
4-({6-[(2-chlorophenyl)methyl]-5-methyl-3,7-dioxo-7H-[1,3]thiazolo[3,2-a]pyrimidin-2(3H)-ylidene}methyl)-2-methoxyphenyl acetate
4-({6-[(2-chlorophenyl)methyl]-5-methyl-3,7-dioxo-7H-[1,3]thiazolo[3,2-a]pyrimidin-2(3H)-ylidene}methyl)-2-methoxyphenyl acetate
Compound characteristics
| Compound ID: | Y070-3171 |
| Compound Name: | 4-({6-[(2-chlorophenyl)methyl]-5-methyl-3,7-dioxo-7H-[1,3]thiazolo[3,2-a]pyrimidin-2(3H)-ylidene}methyl)-2-methoxyphenyl acetate |
| Molecular Weight: | 482.94 |
| Molecular Formula: | C24 H19 Cl N2 O5 S |
| Smiles: | CC1=C(Cc2ccccc2[Cl])C(N=C2N1C(/C(=C\c1ccc(c(c1)OC)OC(C)=O)S2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8157 |
| logD: | 3.8157 |
| logSw: | -4.4615 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 67.252 |
| InChI Key: | YGZWEPSBBFVOEF-UHFFFAOYSA-N |