2-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}-N-(2-pentanamidoethyl)-1,3-thiazole-4-carboxamide
Chemical Structure Depiction of
2-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}-N-(2-pentanamidoethyl)-1,3-thiazole-4-carboxamide
2-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}-N-(2-pentanamidoethyl)-1,3-thiazole-4-carboxamide
Compound characteristics
| Compound ID: | V010-1148 |
| Compound Name: | 2-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}-N-(2-pentanamidoethyl)-1,3-thiazole-4-carboxamide |
| Molecular Weight: | 417.57 |
| Molecular Formula: | C22 H31 N3 O3 S |
| Smiles: | CCCCC(NCCNC(c1csc(COc2cc(C)ccc2C(C)C)n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.017 |
| logD: | 4.017 |
| logSw: | -3.9547 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.893 |
| InChI Key: | XFMWKBCWFXGWOD-UHFFFAOYSA-N |