N-[3-(3,3-dimethylbutanamido)propyl]-2-[(3,5-dimethylphenoxy)methyl]-1,3-thiazole-4-carboxamide
Chemical Structure Depiction of
N-[3-(3,3-dimethylbutanamido)propyl]-2-[(3,5-dimethylphenoxy)methyl]-1,3-thiazole-4-carboxamide
N-[3-(3,3-dimethylbutanamido)propyl]-2-[(3,5-dimethylphenoxy)methyl]-1,3-thiazole-4-carboxamide
Compound characteristics
| Compound ID: | V011-7822 |
| Compound Name: | N-[3-(3,3-dimethylbutanamido)propyl]-2-[(3,5-dimethylphenoxy)methyl]-1,3-thiazole-4-carboxamide |
| Molecular Weight: | 417.57 |
| Molecular Formula: | C22 H31 N3 O3 S |
| Smiles: | Cc1cc(C)cc(c1)OCc1nc(cs1)C(NCCCNC(CC(C)(C)C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8987 |
| logD: | 3.8987 |
| logSw: | -3.8743 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.806 |
| InChI Key: | PJPAKRDDKCTYRR-UHFFFAOYSA-N |