N~3~-[2-(3,4-dimethoxyphenyl)ethyl]-N-[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-N~3~-(phenoxyacetyl)-beta-alaninamide
Chemical Structure Depiction of
N~3~-[2-(3,4-dimethoxyphenyl)ethyl]-N-[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-N~3~-(phenoxyacetyl)-beta-alaninamide
N~3~-[2-(3,4-dimethoxyphenyl)ethyl]-N-[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-N~3~-(phenoxyacetyl)-beta-alaninamide
Compound characteristics
| Compound ID: | V026-7591 |
| Compound Name: | N~3~-[2-(3,4-dimethoxyphenyl)ethyl]-N-[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-N~3~-(phenoxyacetyl)-beta-alaninamide |
| Molecular Weight: | 576.67 |
| Molecular Formula: | C30 H32 N4 O6 S |
| Salt: | not_available |
| Smiles: | COc1cccc(c1)c1nnc(NC(CCN(CCc2ccc(c(c2)OC)OC)C(COc2ccccc2)=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.9087 |
| logD: | 3.9084 |
| logSw: | -4.0211 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.334 |
| InChI Key: | UBRXLZLOXWKTEC-UHFFFAOYSA-N |