N~3~-(1-acetyl-2-methyl-2,3-dihydro-1H-indole-5-sulfonyl)-N-(5-chloro-2,4-dimethoxyphenyl)-beta-alaninamide
Chemical Structure Depiction of
N~3~-(1-acetyl-2-methyl-2,3-dihydro-1H-indole-5-sulfonyl)-N-(5-chloro-2,4-dimethoxyphenyl)-beta-alaninamide
N~3~-(1-acetyl-2-methyl-2,3-dihydro-1H-indole-5-sulfonyl)-N-(5-chloro-2,4-dimethoxyphenyl)-beta-alaninamide
Compound characteristics
| Compound ID: | E570-2187 |
| Compound Name: | N~3~-(1-acetyl-2-methyl-2,3-dihydro-1H-indole-5-sulfonyl)-N-(5-chloro-2,4-dimethoxyphenyl)-beta-alaninamide |
| Molecular Weight: | 495.98 |
| Molecular Formula: | C22 H26 Cl N3 O6 S |
| Smiles: | CC1Cc2cc(ccc2N1C(C)=O)S(NCCC(Nc1cc(c(cc1OC)OC)[Cl])=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5272 |
| logD: | 2.4702 |
| logSw: | -3.4324 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 94.908 |
| InChI Key: | XXGGBDYGXYHAQX-CYBMUJFWSA-N |