N-[rel-(1R,2S)-2-(3,4-dihydroisoquinoline-2(1H)-carbonyl)cyclopentyl]-1,3-thiazole-4-carboxamide
Chemical Structure Depiction of
N-[rel-(1R,2S)-2-(3,4-dihydroisoquinoline-2(1H)-carbonyl)cyclopentyl]-1,3-thiazole-4-carboxamide
N-[rel-(1R,2S)-2-(3,4-dihydroisoquinoline-2(1H)-carbonyl)cyclopentyl]-1,3-thiazole-4-carboxamide
Compound characteristics
| Compound ID: | CM2661-3680 |
| Compound Name: | N-[rel-(1R,2S)-2-(3,4-dihydroisoquinoline-2(1H)-carbonyl)cyclopentyl]-1,3-thiazole-4-carboxamide |
| Molecular Weight: | 355.46 |
| Molecular Formula: | C19 H21 N3 O2 S |
| Smiles: | C1C[C@H](C(N2CCc3ccccc3C2)=O)[C@@H](C1)NC(c1cscn1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.3091 |
| logD: | 2.3091 |
| logSw: | -2.864 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.071 |
| InChI Key: | WDXKKTARIZDMLB-JKSUJKDBSA-N |