N~3~-[1-(cyclopropanecarbonyl)-2,3-dihydro-1H-indole-5-sulfonyl]-N-[(thiophen-2-yl)methyl]-beta-alaninamide
Chemical Structure Depiction of
N~3~-[1-(cyclopropanecarbonyl)-2,3-dihydro-1H-indole-5-sulfonyl]-N-[(thiophen-2-yl)methyl]-beta-alaninamide
N~3~-[1-(cyclopropanecarbonyl)-2,3-dihydro-1H-indole-5-sulfonyl]-N-[(thiophen-2-yl)methyl]-beta-alaninamide
Compound characteristics
| Compound ID: | G849-0096 |
| Compound Name: | N~3~-[1-(cyclopropanecarbonyl)-2,3-dihydro-1H-indole-5-sulfonyl]-N-[(thiophen-2-yl)methyl]-beta-alaninamide |
| Molecular Weight: | 433.55 |
| Molecular Formula: | C20 H23 N3 O4 S2 |
| Smiles: | C(CNS(c1ccc2c(CCN2C(C2CC2)=O)c1)(=O)=O)C(NCc1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3616 |
| logD: | 2.3615 |
| logSw: | -2.9554 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.53 |
| InChI Key: | JSFUDSCXVCLBCH-UHFFFAOYSA-N |