N,N-diethyl-4-{2-[(4-fluorophenyl)imino]-3-(3-hydroxypropyl)-2,3-dihydro-1,3-thiazol-4-yl}benzene-1-sulfonamide--hydrogen bromide (1/1)
Chemical Structure Depiction of
N,N-diethyl-4-{2-[(4-fluorophenyl)imino]-3-(3-hydroxypropyl)-2,3-dihydro-1,3-thiazol-4-yl}benzene-1-sulfonamide--hydrogen bromide (1/1)
N,N-diethyl-4-{2-[(4-fluorophenyl)imino]-3-(3-hydroxypropyl)-2,3-dihydro-1,3-thiazol-4-yl}benzene-1-sulfonamide--hydrogen bromide (1/1)
Compound characteristics
| Compound ID: | 8009-0725 |
| Compound Name: | N,N-diethyl-4-{2-[(4-fluorophenyl)imino]-3-(3-hydroxypropyl)-2,3-dihydro-1,3-thiazol-4-yl}benzene-1-sulfonamide--hydrogen bromide (1/1) |
| Molecular Weight: | 544.5 |
| Molecular Formula: | C22 H26 F N3 O3 S2 |
| Salt: | HBr |
| Smiles: | CCN(CC)S(c1ccc(cc1)C1=CSC(=N/c2ccc(cc2)F)\N1CCCO)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9234 |
| logD: | 3.9234 |
| logSw: | -3.9826 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.305 |
| InChI Key: | FHTAJYDIZMSMHS-GYHWCHFESA-N |