methyl (3-{[1-(4-methoxyphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl}-1H-indol-1-yl)acetate
Chemical Structure Depiction of
methyl (3-{[1-(4-methoxyphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl}-1H-indol-1-yl)acetate
methyl (3-{[1-(4-methoxyphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl}-1H-indol-1-yl)acetate
Compound characteristics
| Compound ID: | 4724-4631 |
| Compound Name: | methyl (3-{[1-(4-methoxyphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl}-1H-indol-1-yl)acetate |
| Molecular Weight: | 433.42 |
| Molecular Formula: | C23 H19 N3 O6 |
| Smiles: | COC(Cn1cc(\C=C2/C(NC(N(C2=O)c2ccc(cc2)OC)=O)=O)c2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8941 |
| logD: | 1.3228 |
| logSw: | -2.5438 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.517 |
| InChI Key: | KIMJYSXULFQDAT-UHFFFAOYSA-N |