1-(3-{[3-(2-hydroxyethyl)-4-[4-(morpholine-4-sulfonyl)phenyl]-1,3-thiazol-2(3H)-ylidene]amino}phenyl)ethan-1-one--hydrogen bromide (1/1)
Chemical Structure Depiction of
1-(3-{[3-(2-hydroxyethyl)-4-[4-(morpholine-4-sulfonyl)phenyl]-1,3-thiazol-2(3H)-ylidene]amino}phenyl)ethan-1-one--hydrogen bromide (1/1)
1-(3-{[3-(2-hydroxyethyl)-4-[4-(morpholine-4-sulfonyl)phenyl]-1,3-thiazol-2(3H)-ylidene]amino}phenyl)ethan-1-one--hydrogen bromide (1/1)
Compound characteristics
| Compound ID: | Y501-0082 |
| Compound Name: | 1-(3-{[3-(2-hydroxyethyl)-4-[4-(morpholine-4-sulfonyl)phenyl]-1,3-thiazol-2(3H)-ylidene]amino}phenyl)ethan-1-one--hydrogen bromide (1/1) |
| Molecular Weight: | 568.51 |
| Molecular Formula: | C23 H25 N3 O5 S2 |
| Salt: | HBr |
| Smiles: | CC(c1cccc(c1)/N=C1/N(CCO)C(=CS1)c1ccc(cc1)S(N1CCOCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5504 |
| logD: | 2.5504 |
| logSw: | -2.7071 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.655 |
| InChI Key: | MBXRJKKISHACQM-VHXPQNKSSA-N |