butyl 4-[1,3-dimethyl-2,4-dioxo-7-(thiophen-2-yl)-1,2,3,4-tetrahydro-8H-imidazo[2,1-f]purin-8-yl]benzoate
Chemical Structure Depiction of
butyl 4-[1,3-dimethyl-2,4-dioxo-7-(thiophen-2-yl)-1,2,3,4-tetrahydro-8H-imidazo[2,1-f]purin-8-yl]benzoate
butyl 4-[1,3-dimethyl-2,4-dioxo-7-(thiophen-2-yl)-1,2,3,4-tetrahydro-8H-imidazo[2,1-f]purin-8-yl]benzoate
Compound characteristics
| Compound ID: | 8019-8063 |
| Compound Name: | butyl 4-[1,3-dimethyl-2,4-dioxo-7-(thiophen-2-yl)-1,2,3,4-tetrahydro-8H-imidazo[2,1-f]purin-8-yl]benzoate |
| Molecular Weight: | 477.54 |
| Molecular Formula: | C24 H23 N5 O4 S |
| Smiles: | CCCCOC(c1ccc(cc1)N1C(=Cn2c3C(N(C)C(N(C)c3nc12)=O)=O)c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9959 |
| logD: | 4.9959 |
| logSw: | -4.6421 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.409 |
| InChI Key: | MXCSKMARZCZZSZ-UHFFFAOYSA-N |