N~3~-(1-acetyl-2,3-dihydro-1H-indole-5-sulfonyl)-N-(4-methoxyphenyl)-beta-alaninamide
Chemical Structure Depiction of
N~3~-(1-acetyl-2,3-dihydro-1H-indole-5-sulfonyl)-N-(4-methoxyphenyl)-beta-alaninamide
N~3~-(1-acetyl-2,3-dihydro-1H-indole-5-sulfonyl)-N-(4-methoxyphenyl)-beta-alaninamide
Compound characteristics
| Compound ID: | C450-0774 |
| Compound Name: | N~3~-(1-acetyl-2,3-dihydro-1H-indole-5-sulfonyl)-N-(4-methoxyphenyl)-beta-alaninamide |
| Molecular Weight: | 417.48 |
| Molecular Formula: | C20 H23 N3 O5 S |
| Smiles: | CC(N1CCc2cc(ccc12)S(NCCC(Nc1ccc(cc1)OC)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8575 |
| logD: | 1.8574 |
| logSw: | -2.8053 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.95 |
| InChI Key: | APJCQRRSGLGPHR-UHFFFAOYSA-N |