rel-(3R,4S)-3-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-4-(thiophene-2-sulfonyl)-1lambda~6~-thiolane-1,1-dione
Chemical Structure Depiction of
rel-(3R,4S)-3-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-4-(thiophene-2-sulfonyl)-1lambda~6~-thiolane-1,1-dione
rel-(3R,4S)-3-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-4-(thiophene-2-sulfonyl)-1lambda~6~-thiolane-1,1-dione
Compound characteristics
| Compound ID: | D470-1633 |
| Compound Name: | rel-(3R,4S)-3-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-4-(thiophene-2-sulfonyl)-1lambda~6~-thiolane-1,1-dione |
| Molecular Weight: | 389.55 |
| Molecular Formula: | C16 H23 N O4 S3 |
| Smiles: | C1CCC(CCN[C@H]2CS(C[C@@H]2S(c2cccs2)(=O)=O)(=O)=O)=CC1 |
| Stereo: | RELATIVE |
| logP: | 1.1474 |
| logD: | 1.1474 |
| logSw: | -1.9442 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.9 |
| InChI Key: | VJOLOAZRBYNFDR-HUUCEWRRSA-N |