(4-{[1-(4-methoxyphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl}phenoxy)acetic acid
Chemical Structure Depiction of
(4-{[1-(4-methoxyphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl}phenoxy)acetic acid
(4-{[1-(4-methoxyphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl}phenoxy)acetic acid
Compound characteristics
| Compound ID: | 8013-4283 |
| Compound Name: | (4-{[1-(4-methoxyphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl}phenoxy)acetic acid |
| Molecular Weight: | 396.35 |
| Molecular Formula: | C20 H16 N2 O7 |
| Smiles: | COc1ccc(cc1)N1C(C(=C\c2ccc(cc2)OCC(O)=O)\C(NC1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6614 |
| logD: | -2.5755 |
| logSw: | -2.1364 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.817 |
| InChI Key: | YLYXWJXGQGCFSR-UHFFFAOYSA-N |