4-methyl-3-[4-(2-methylbutanoyl)-1,4-diazepan-1-yl]-5-[4-(propan-2-yl)phenyl]-1H-1lambda~6~,2-thiazole-1,1-dione
Chemical Structure Depiction of
4-methyl-3-[4-(2-methylbutanoyl)-1,4-diazepan-1-yl]-5-[4-(propan-2-yl)phenyl]-1H-1lambda~6~,2-thiazole-1,1-dione
4-methyl-3-[4-(2-methylbutanoyl)-1,4-diazepan-1-yl]-5-[4-(propan-2-yl)phenyl]-1H-1lambda~6~,2-thiazole-1,1-dione
Compound characteristics
| Compound ID: | P533-0376 |
| Compound Name: | 4-methyl-3-[4-(2-methylbutanoyl)-1,4-diazepan-1-yl]-5-[4-(propan-2-yl)phenyl]-1H-1lambda~6~,2-thiazole-1,1-dione |
| Molecular Weight: | 431.6 |
| Molecular Formula: | C23 H33 N3 O3 S |
| Smiles: | CCC(C)C(N1CCCN(CC1)C1C(C)=C(c2ccc(cc2)C(C)C)S(N=1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3948 |
| logD: | 4.3948 |
| logSw: | -4.1069 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 60.189 |
| InChI Key: | ZOCJWVHPYOBHLQ-KRWDZBQOSA-N |