5-(3-bromophenyl)-4-methyl-3-{[(2-methylphenyl)methyl]amino}-1H-1lambda~6~,2-thiazole-1,1-dione--hydrogen chloride (1/1)
Chemical Structure Depiction of
5-(3-bromophenyl)-4-methyl-3-{[(2-methylphenyl)methyl]amino}-1H-1lambda~6~,2-thiazole-1,1-dione--hydrogen chloride (1/1)
5-(3-bromophenyl)-4-methyl-3-{[(2-methylphenyl)methyl]amino}-1H-1lambda~6~,2-thiazole-1,1-dione--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | E013-2099 |
| Compound Name: | 5-(3-bromophenyl)-4-methyl-3-{[(2-methylphenyl)methyl]amino}-1H-1lambda~6~,2-thiazole-1,1-dione--hydrogen chloride (1/1) |
| Molecular Weight: | 441.77 |
| Molecular Formula: | C18 H17 Br N2 O2 S |
| Salt: | HCl |
| Smiles: | CC1=C(c2cccc(c2)[Br])S(N=C1NCc1ccccc1C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5719 |
| logD: | 4.5716 |
| logSw: | -4.402 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.167 |
| InChI Key: | SYHPJSUQMGEJGC-UHFFFAOYSA-N |