N-{3-[(1,3-benzothiazol-2-yl)amino]-3-oxopropyl}-5,6,7-trimethoxy-1H-indole-2-carboxamide
Chemical Structure Depiction of
N-{3-[(1,3-benzothiazol-2-yl)amino]-3-oxopropyl}-5,6,7-trimethoxy-1H-indole-2-carboxamide
N-{3-[(1,3-benzothiazol-2-yl)amino]-3-oxopropyl}-5,6,7-trimethoxy-1H-indole-2-carboxamide
Compound characteristics
| Compound ID: | Y040-8959 |
| Compound Name: | N-{3-[(1,3-benzothiazol-2-yl)amino]-3-oxopropyl}-5,6,7-trimethoxy-1H-indole-2-carboxamide |
| Molecular Weight: | 454.5 |
| Molecular Formula: | C22 H22 N4 O5 S |
| Smiles: | COc1cc2cc(C(NCCC(Nc3nc4ccccc4s3)=O)=O)[nH]c2c(c1OC)OC |
| Stereo: | ACHIRAL |
| logP: | 3.258 |
| logD: | 3.2579 |
| logSw: | -3.5514 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 90.588 |
| InChI Key: | NNDQVCWBKZBPTR-UHFFFAOYSA-N |