N~3~-(1-acetyl-2-methyl-2,3-dihydro-1H-indole-5-sulfonyl)-N-{[4-(dimethylamino)phenyl]methyl}-beta-alaninamide
Chemical Structure Depiction of
N~3~-(1-acetyl-2-methyl-2,3-dihydro-1H-indole-5-sulfonyl)-N-{[4-(dimethylamino)phenyl]methyl}-beta-alaninamide
N~3~-(1-acetyl-2-methyl-2,3-dihydro-1H-indole-5-sulfonyl)-N-{[4-(dimethylamino)phenyl]methyl}-beta-alaninamide
Compound characteristics
| Compound ID: | E570-2400 |
| Compound Name: | N~3~-(1-acetyl-2-methyl-2,3-dihydro-1H-indole-5-sulfonyl)-N-{[4-(dimethylamino)phenyl]methyl}-beta-alaninamide |
| Molecular Weight: | 458.58 |
| Molecular Formula: | C23 H30 N4 O4 S |
| Smiles: | CC1Cc2cc(ccc2N1C(C)=O)S(NCCC(NCc1ccc(cc1)N(C)C)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0186 |
| logD: | 2.0031 |
| logSw: | -2.9752 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.471 |
| InChI Key: | GFBZCJYNXQQMGJ-MRXNPFEDSA-N |