N-(butan-2-yl)-4-({4-methyl-1,1,3-trioxo-5-[4-(propan-2-yl)phenyl]-1,3-dihydro-2H-1lambda~6~,2-thiazol-2-yl}methyl)benzamide
Chemical Structure Depiction of
N-(butan-2-yl)-4-({4-methyl-1,1,3-trioxo-5-[4-(propan-2-yl)phenyl]-1,3-dihydro-2H-1lambda~6~,2-thiazol-2-yl}methyl)benzamide
N-(butan-2-yl)-4-({4-methyl-1,1,3-trioxo-5-[4-(propan-2-yl)phenyl]-1,3-dihydro-2H-1lambda~6~,2-thiazol-2-yl}methyl)benzamide
Compound characteristics
| Compound ID: | G206-2646 |
| Compound Name: | N-(butan-2-yl)-4-({4-methyl-1,1,3-trioxo-5-[4-(propan-2-yl)phenyl]-1,3-dihydro-2H-1lambda~6~,2-thiazol-2-yl}methyl)benzamide |
| Molecular Weight: | 454.59 |
| Molecular Formula: | C25 H30 N2 O4 S |
| Smiles: | CCC(C)NC(c1ccc(CN2C(C(C)=C(c3ccc(cc3)C(C)C)S2(=O)=O)=O)cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1032 |
| logD: | 4.1032 |
| logSw: | -4.03 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.31 |
| InChI Key: | UMGWXUKIBXWTBJ-KRWDZBQOSA-N |