N~3~-(1-acetyl-2-methyl-2,3-dihydro-1H-indole-5-sulfonyl)-N-(6-methoxy-1,3-benzothiazol-2-yl)-beta-alaninamide
Chemical Structure Depiction of
N~3~-(1-acetyl-2-methyl-2,3-dihydro-1H-indole-5-sulfonyl)-N-(6-methoxy-1,3-benzothiazol-2-yl)-beta-alaninamide
N~3~-(1-acetyl-2-methyl-2,3-dihydro-1H-indole-5-sulfonyl)-N-(6-methoxy-1,3-benzothiazol-2-yl)-beta-alaninamide
Compound characteristics
| Compound ID: | E570-2168 |
| Compound Name: | N~3~-(1-acetyl-2-methyl-2,3-dihydro-1H-indole-5-sulfonyl)-N-(6-methoxy-1,3-benzothiazol-2-yl)-beta-alaninamide |
| Molecular Weight: | 488.58 |
| Molecular Formula: | C22 H24 N4 O5 S2 |
| Smiles: | CC1Cc2cc(ccc2N1C(C)=O)S(NCCC(Nc1nc2ccc(cc2s1)OC)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0547 |
| logD: | 3.0545 |
| logSw: | -3.6811 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 97.65 |
| InChI Key: | COATZFSTJMGTPX-CYBMUJFWSA-N |