3-acetamido-N-{[5-(azepane-1-sulfonyl)thiophen-2-yl]methyl}-4-methylbenzamide
Chemical Structure Depiction of
3-acetamido-N-{[5-(azepane-1-sulfonyl)thiophen-2-yl]methyl}-4-methylbenzamide
3-acetamido-N-{[5-(azepane-1-sulfonyl)thiophen-2-yl]methyl}-4-methylbenzamide
Compound characteristics
| Compound ID: | L470-0606 |
| Compound Name: | 3-acetamido-N-{[5-(azepane-1-sulfonyl)thiophen-2-yl]methyl}-4-methylbenzamide |
| Molecular Weight: | 449.59 |
| Molecular Formula: | C21 H27 N3 O4 S2 |
| Smiles: | CC(Nc1cc(ccc1C)C(NCc1ccc(s1)S(N1CCCCCC1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6899 |
| logD: | 2.6899 |
| logSw: | -3.1429 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.276 |
| InChI Key: | ZFENVJNKLLRXCK-UHFFFAOYSA-N |