6-bromo-3-[2-(4-methylphenyl)-1,3-thiazolidine-3-carbonyl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-bromo-3-[2-(4-methylphenyl)-1,3-thiazolidine-3-carbonyl]-2H-1-benzopyran-2-one
6-bromo-3-[2-(4-methylphenyl)-1,3-thiazolidine-3-carbonyl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 5279-0004 |
| Compound Name: | 6-bromo-3-[2-(4-methylphenyl)-1,3-thiazolidine-3-carbonyl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 430.32 |
| Molecular Formula: | C20 H16 Br N O3 S |
| Smiles: | Cc1ccc(cc1)C1N(CCS1)C(C1=Cc2cc(ccc2OC1=O)[Br])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3552 |
| logD: | 4.3552 |
| logSw: | -4.3995 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 37.598 |
| InChI Key: | AHLOYDTWZUVSAV-IBGZPJMESA-N |