3-[4-(ethanesulfonyl)-1,4-diazepan-1-yl]-5-(4-fluorophenyl)-4-methyl-1H-1lambda~6~,2-thiazole-1,1-dione
Chemical Structure Depiction of
3-[4-(ethanesulfonyl)-1,4-diazepan-1-yl]-5-(4-fluorophenyl)-4-methyl-1H-1lambda~6~,2-thiazole-1,1-dione
3-[4-(ethanesulfonyl)-1,4-diazepan-1-yl]-5-(4-fluorophenyl)-4-methyl-1H-1lambda~6~,2-thiazole-1,1-dione
Compound characteristics
| Compound ID: | T380-0022 |
| Compound Name: | 3-[4-(ethanesulfonyl)-1,4-diazepan-1-yl]-5-(4-fluorophenyl)-4-methyl-1H-1lambda~6~,2-thiazole-1,1-dione |
| Molecular Weight: | 415.5 |
| Molecular Formula: | C17 H22 F N3 O4 S2 |
| Smiles: | CCS(N1CCCN(CC1)C1C(C)=C(c2ccc(cc2)F)S(N=1)(=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.893 |
| logD: | 1.893 |
| logSw: | -2.4033 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 75.146 |
| InChI Key: | HEZZOXZNXPTIEO-UHFFFAOYSA-N |