[5-({3-methoxy-4-[(4-methylbenzoyl)oxy]phenyl}methylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid
Chemical Structure Depiction of
[5-({3-methoxy-4-[(4-methylbenzoyl)oxy]phenyl}methylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid
[5-({3-methoxy-4-[(4-methylbenzoyl)oxy]phenyl}methylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid
Compound characteristics
| Compound ID: | 3229-2080 |
| Compound Name: | [5-({3-methoxy-4-[(4-methylbenzoyl)oxy]phenyl}methylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid |
| Molecular Weight: | 443.5 |
| Molecular Formula: | C21 H17 N O6 S2 |
| Smiles: | Cc1ccc(cc1)C(=O)Oc1ccc(\C=C2/C(N(CC(O)=O)C(=S)S2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.7303 |
| logD: | -0.3887 |
| logSw: | -3.1244 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.193 |
| InChI Key: | KNJCVDSHTBIZKT-UHFFFAOYSA-N |