1-{[3-(4-tert-butylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-3-(4-chlorophenyl)thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
1-{[3-(4-tert-butylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-3-(4-chlorophenyl)thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
1-{[3-(4-tert-butylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-3-(4-chlorophenyl)thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | L927-0104 |
| Compound Name: | 1-{[3-(4-tert-butylphenyl)-1,2,4-oxadiazol-5-yl]methyl}-3-(4-chlorophenyl)thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 492.98 |
| Molecular Formula: | C25 H21 Cl N4 O3 S |
| Smiles: | CC(C)(C)c1ccc(cc1)c1nc(CN2C(N(C(c3c2ccs3)=O)c2ccc(cc2)[Cl])=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 6.6206 |
| logD: | 6.6206 |
| logSw: | -6.3271 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 63.017 |
| InChI Key: | WQLPBFOMZSQFCL-UHFFFAOYSA-N |