1-acetyl-5-(azepane-1-sulfonyl)-2,3-dihydro-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
1-acetyl-5-(azepane-1-sulfonyl)-2,3-dihydro-1H-indole-2-carboxylic acid
1-acetyl-5-(azepane-1-sulfonyl)-2,3-dihydro-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | C800-0973 |
| Compound Name: | 1-acetyl-5-(azepane-1-sulfonyl)-2,3-dihydro-1H-indole-2-carboxylic acid |
| Molecular Weight: | 366.43 |
| Molecular Formula: | C17 H22 N2 O5 S |
| Smiles: | CC(N1C(Cc2cc(ccc12)S(N1CCCCCC1)(=O)=O)C(O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.2589 |
| logD: | -2.7219 |
| logSw: | -2.3046 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.455 |
| InChI Key: | DKWUISAUUQRGMJ-MRXNPFEDSA-N |