N-(butan-2-yl)-N~3~-[1-(cyclopropanecarbonyl)-2-methyl-2,3-dihydro-1H-indole-5-sulfonyl]-beta-alaninamide
Chemical Structure Depiction of
N-(butan-2-yl)-N~3~-[1-(cyclopropanecarbonyl)-2-methyl-2,3-dihydro-1H-indole-5-sulfonyl]-beta-alaninamide
N-(butan-2-yl)-N~3~-[1-(cyclopropanecarbonyl)-2-methyl-2,3-dihydro-1H-indole-5-sulfonyl]-beta-alaninamide
Compound characteristics
| Compound ID: | E570-2450 |
| Compound Name: | N-(butan-2-yl)-N~3~-[1-(cyclopropanecarbonyl)-2-methyl-2,3-dihydro-1H-indole-5-sulfonyl]-beta-alaninamide |
| Molecular Weight: | 407.53 |
| Molecular Formula: | C20 H29 N3 O4 S |
| Smiles: | CCC(C)NC(CCNS(c1ccc2c(CC(C)N2C(C2CC2)=O)c1)(=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.2607 |
| logD: | 2.2606 |
| logSw: | -2.9406 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.163 |
| InChI Key: | XLZAWZZAFGCHNX-UHFFFAOYSA-N |