rel-(3R,4S)-3-[(3-methylbutyl)amino]-4-(thiophene-2-sulfonyl)-1lambda~6~-thiolane-1,1-dione
Chemical Structure Depiction of
rel-(3R,4S)-3-[(3-methylbutyl)amino]-4-(thiophene-2-sulfonyl)-1lambda~6~-thiolane-1,1-dione
rel-(3R,4S)-3-[(3-methylbutyl)amino]-4-(thiophene-2-sulfonyl)-1lambda~6~-thiolane-1,1-dione
Compound characteristics
| Compound ID: | D470-1709 |
| Compound Name: | rel-(3R,4S)-3-[(3-methylbutyl)amino]-4-(thiophene-2-sulfonyl)-1lambda~6~-thiolane-1,1-dione |
| Molecular Weight: | 351.5 |
| Molecular Formula: | C13 H21 N O4 S3 |
| Smiles: | CC(C)CCN[C@H]1CS(C[C@@H]1S(c1cccs1)(=O)=O)(=O)=O |
| Stereo: | RELATIVE |
| logP: | 1.009 |
| logD: | 1.0084 |
| logSw: | -2.002 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.98 |
| InChI Key: | MQTVWAZNHTVONC-VXGBXAGGSA-N |