N-(5-benzyl-4,5,6,7-tetrahydro[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-(4-fluorobenzene-1-sulfonyl)propanamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-(5-benzyl-4,5,6,7-tetrahydro[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-(4-fluorobenzene-1-sulfonyl)propanamide--hydrogen chloride (1/1)
N-(5-benzyl-4,5,6,7-tetrahydro[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-(4-fluorobenzene-1-sulfonyl)propanamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | F048-0746 |
| Compound Name: | N-(5-benzyl-4,5,6,7-tetrahydro[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-(4-fluorobenzene-1-sulfonyl)propanamide--hydrogen chloride (1/1) |
| Molecular Weight: | 496.02 |
| Molecular Formula: | C22 H22 F N3 O3 S2 |
| Salt: | HCl |
| Smiles: | C(CS(c1ccc(cc1)F)(=O)=O)C(Nc1nc2CCN(Cc3ccccc3)Cc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2222 |
| logD: | 3.2222 |
| logSw: | -3.4907 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.094 |
| InChI Key: | LIFGHRUURYAKQO-UHFFFAOYSA-N |