3-[4-(4-chlorophenyl)-5-methyl-1,3-thiazol-2-yl]-8-ethoxy-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-[4-(4-chlorophenyl)-5-methyl-1,3-thiazol-2-yl]-8-ethoxy-2H-1-benzopyran-2-one
3-[4-(4-chlorophenyl)-5-methyl-1,3-thiazol-2-yl]-8-ethoxy-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | K277-0114 |
| Compound Name: | 3-[4-(4-chlorophenyl)-5-methyl-1,3-thiazol-2-yl]-8-ethoxy-2H-1-benzopyran-2-one |
| Molecular Weight: | 397.88 |
| Molecular Formula: | C21 H16 Cl N O3 S |
| Smiles: | CCOc1cccc2C=C(C(=O)Oc12)c1nc(c2ccc(cc2)[Cl])c(C)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.8327 |
| logD: | 5.8327 |
| logSw: | -6.0452 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.287 |
| InChI Key: | NULGAGDWAFNPAT-UHFFFAOYSA-N |