4-(azepane-1-sulfonyl)-N-[5-(propan-2-yl)-4,5,6,7-tetrahydro[1,3]thiazolo[5,4-c]pyridin-2-yl]benzamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
4-(azepane-1-sulfonyl)-N-[5-(propan-2-yl)-4,5,6,7-tetrahydro[1,3]thiazolo[5,4-c]pyridin-2-yl]benzamide--hydrogen chloride (1/1)
4-(azepane-1-sulfonyl)-N-[5-(propan-2-yl)-4,5,6,7-tetrahydro[1,3]thiazolo[5,4-c]pyridin-2-yl]benzamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | F048-0354 |
| Compound Name: | 4-(azepane-1-sulfonyl)-N-[5-(propan-2-yl)-4,5,6,7-tetrahydro[1,3]thiazolo[5,4-c]pyridin-2-yl]benzamide--hydrogen chloride (1/1) |
| Molecular Weight: | 499.09 |
| Molecular Formula: | C22 H30 N4 O3 S2 |
| Salt: | HCl |
| Smiles: | CC(C)N1CCc2c(C1)sc(NC(c1ccc(cc1)S(N1CCCCCC1)(=O)=O)=O)n2 |
| Stereo: | ACHIRAL |
| logP: | 3.9379 |
| logD: | 3.9379 |
| logSw: | -3.8918 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.637 |
| InChI Key: | XDCQVDOJIPQCMP-UHFFFAOYSA-N |