3-(2-acetamidoethyl)-5-methoxy-7-nitro-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
3-(2-acetamidoethyl)-5-methoxy-7-nitro-1H-indole-2-carboxylic acid
3-(2-acetamidoethyl)-5-methoxy-7-nitro-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | 4513-1376F |
| Compound Name: | 3-(2-acetamidoethyl)-5-methoxy-7-nitro-1H-indole-2-carboxylic acid |
| Molecular Weight: | 321.29 |
| Molecular Formula: | C14 H15 N3 O6 |
| Smiles: | CC(NCCc1c2cc(cc(c2[nH]c1C(O)=O)[N+]([O-])=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 0.6518 |
| logD: | -2.1412 |
| logSw: | -1.7579 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 104.587 |
| InChI Key: | RALJLIILLIROHI-UHFFFAOYSA-N |