N-{[3-(4-methyl-1,3-thiazol-2-yl)phenyl]methyl}-4-[(1-oxo-1,3-dihydro-2H-isoindol-2-yl)methyl]cyclohexane-1-carboxamide
Chemical Structure Depiction of
N-{[3-(4-methyl-1,3-thiazol-2-yl)phenyl]methyl}-4-[(1-oxo-1,3-dihydro-2H-isoindol-2-yl)methyl]cyclohexane-1-carboxamide
N-{[3-(4-methyl-1,3-thiazol-2-yl)phenyl]methyl}-4-[(1-oxo-1,3-dihydro-2H-isoindol-2-yl)methyl]cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | D757-0046 |
| Compound Name: | N-{[3-(4-methyl-1,3-thiazol-2-yl)phenyl]methyl}-4-[(1-oxo-1,3-dihydro-2H-isoindol-2-yl)methyl]cyclohexane-1-carboxamide |
| Molecular Weight: | 459.61 |
| Molecular Formula: | C27 H29 N3 O2 S |
| Smiles: | Cc1csc(c2cccc(CNC([C@H]3CC[C@@H](CC3)CN3Cc4ccccc4C3=O)=O)c2)n1 |
| Stereo: | ABSOLUTE |
| logP: | 4.6066 |
| logD: | 4.6066 |
| logSw: | -4.5248 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.031 |
| InChI Key: | SKTTUFWPUOFHPB-UHFFFAOYSA-N |