N~3~-[1-(cyclopropanecarbonyl)-2-methyl-2,3-dihydro-1H-indole-5-sulfonyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-beta-alaninamide
Chemical Structure Depiction of
N~3~-[1-(cyclopropanecarbonyl)-2-methyl-2,3-dihydro-1H-indole-5-sulfonyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-beta-alaninamide
N~3~-[1-(cyclopropanecarbonyl)-2-methyl-2,3-dihydro-1H-indole-5-sulfonyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-beta-alaninamide
Compound characteristics
| Compound ID: | E570-2559 |
| Compound Name: | N~3~-[1-(cyclopropanecarbonyl)-2-methyl-2,3-dihydro-1H-indole-5-sulfonyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-beta-alaninamide |
| Molecular Weight: | 481.61 |
| Molecular Formula: | C26 H31 N3 O4 S |
| Smiles: | CC1Cc2cc(ccc2N1C(C1CC1)=O)S(NCCC(NC1CCCc2ccccc12)=O)(=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.7428 |
| logD: | 3.7427 |
| logSw: | -4.0367 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.294 |
| InChI Key: | BTHWPAZJORPABA-UHFFFAOYSA-N |