6-bromo-3-[2-(4-methoxyphenyl)-1,3-thiazolidine-3-carbonyl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-bromo-3-[2-(4-methoxyphenyl)-1,3-thiazolidine-3-carbonyl]-2H-1-benzopyran-2-one
6-bromo-3-[2-(4-methoxyphenyl)-1,3-thiazolidine-3-carbonyl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 1600-0192 |
| Compound Name: | 6-bromo-3-[2-(4-methoxyphenyl)-1,3-thiazolidine-3-carbonyl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 446.32 |
| Molecular Formula: | C20 H16 Br N O4 S |
| Smiles: | COc1ccc(cc1)C1N(CCS1)C(C1=Cc2cc(ccc2OC1=O)[Br])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9142 |
| logD: | 3.9142 |
| logSw: | -4.1329 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 45.142 |
| InChI Key: | DUNIYKRYQDDQQL-IBGZPJMESA-N |