4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-[2-(2-methylpropanamido)-1,3-benzothiazol-5-yl]butanamide
Chemical Structure Depiction of
4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-[2-(2-methylpropanamido)-1,3-benzothiazol-5-yl]butanamide
4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-[2-(2-methylpropanamido)-1,3-benzothiazol-5-yl]butanamide
Compound characteristics
| Compound ID: | F782-1903 |
| Compound Name: | 4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-[2-(2-methylpropanamido)-1,3-benzothiazol-5-yl]butanamide |
| Molecular Weight: | 450.52 |
| Molecular Formula: | C23 H22 N4 O4 S |
| Smiles: | [H]c1cc2c(cc1NC(CCCN1C(c3ccccc3C1=O)=O)=O)nc(NC(C(C)C)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 3.3068 |
| logD: | 3.3066 |
| logSw: | -3.7124 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.743 |
| InChI Key: | MMDVMCJEXXSHNC-UHFFFAOYSA-N |