N~3~-[1-(cyclopropanecarbonyl)-2-methyl-2,3-dihydro-1H-indole-5-sulfonyl]-N-(6-methyl-1,3-benzothiazol-2-yl)-beta-alaninamide
Chemical Structure Depiction of
N~3~-[1-(cyclopropanecarbonyl)-2-methyl-2,3-dihydro-1H-indole-5-sulfonyl]-N-(6-methyl-1,3-benzothiazol-2-yl)-beta-alaninamide
N~3~-[1-(cyclopropanecarbonyl)-2-methyl-2,3-dihydro-1H-indole-5-sulfonyl]-N-(6-methyl-1,3-benzothiazol-2-yl)-beta-alaninamide
Compound characteristics
| Compound ID: | E570-2584 |
| Compound Name: | N~3~-[1-(cyclopropanecarbonyl)-2-methyl-2,3-dihydro-1H-indole-5-sulfonyl]-N-(6-methyl-1,3-benzothiazol-2-yl)-beta-alaninamide |
| Molecular Weight: | 498.62 |
| Molecular Formula: | C24 H26 N4 O4 S2 |
| Smiles: | CC1Cc2cc(ccc2N1C(C1CC1)=O)S(NCCC(Nc1nc2ccc(C)cc2s1)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1232 |
| logD: | 4.123 |
| logSw: | -4.2817 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.89 |
| InChI Key: | XGQZVNGSFQHVQX-OAHLLOKOSA-N |