{3-[(1-benzyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]-1H-indol-1-yl}acetic acid
Chemical Structure Depiction of
{3-[(1-benzyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]-1H-indol-1-yl}acetic acid
{3-[(1-benzyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]-1H-indol-1-yl}acetic acid
Compound characteristics
| Compound ID: | 4632-5268 |
| Compound Name: | {3-[(1-benzyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]-1H-indol-1-yl}acetic acid |
| Molecular Weight: | 403.39 |
| Molecular Formula: | C22 H17 N3 O5 |
| Smiles: | C(c1ccccc1)N1C(C(=C\c2cn(CC(O)=O)c3ccccc23)\C(NC1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3217 |
| logD: | -2.6599 |
| logSw: | -1.9909 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.39 |
| InChI Key: | XXWDTLGVDLSIJD-UHFFFAOYSA-N |