3-hydroxy-3-[2-(4-methoxy-3-nitrophenyl)-2-oxoethyl]-1-(prop-2-yn-1-yl)-1,3-dihydro-2H-indol-2-one
Chemical Structure Depiction of
3-hydroxy-3-[2-(4-methoxy-3-nitrophenyl)-2-oxoethyl]-1-(prop-2-yn-1-yl)-1,3-dihydro-2H-indol-2-one
3-hydroxy-3-[2-(4-methoxy-3-nitrophenyl)-2-oxoethyl]-1-(prop-2-yn-1-yl)-1,3-dihydro-2H-indol-2-one
Compound characteristics
| Compound ID: | 4451-0083 |
| Compound Name: | 3-hydroxy-3-[2-(4-methoxy-3-nitrophenyl)-2-oxoethyl]-1-(prop-2-yn-1-yl)-1,3-dihydro-2H-indol-2-one |
| Molecular Weight: | 380.36 |
| Molecular Formula: | C20 H16 N2 O6 |
| Smiles: | COc1ccc(cc1[N+]([O-])=O)C(CC1(C(N(CC#C)c2ccccc12)=O)O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0143 |
| logD: | 2.0143 |
| logSw: | -2.8112 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.004 |
| InChI Key: | UPEPJTNYQFDREH-FQEVSTJZSA-N |