methyl 2-[2-(4-chlorophenyl)-4,6-dioxo-3-phenylhexahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]-4,5-dimethylthiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-[2-(4-chlorophenyl)-4,6-dioxo-3-phenylhexahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]-4,5-dimethylthiophene-3-carboxylate
methyl 2-[2-(4-chlorophenyl)-4,6-dioxo-3-phenylhexahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]-4,5-dimethylthiophene-3-carboxylate
Compound characteristics
| Compound ID: | 4593-5430 |
| Compound Name: | methyl 2-[2-(4-chlorophenyl)-4,6-dioxo-3-phenylhexahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]-4,5-dimethylthiophene-3-carboxylate |
| Molecular Weight: | 496.97 |
| Molecular Formula: | C25 H21 Cl N2 O5 S |
| Smiles: | Cc1c(C(=O)OC)c(N2C(C3C(c4ccccc4)N(c4ccc(cc4)[Cl])OC3C2=O)=O)sc1C |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.4934 |
| logD: | 4.4934 |
| logSw: | -5.2203 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.876 |
| InChI Key: | QRLPNUQHXAAXTP-UHFFFAOYSA-N |