6-[4-(5-methylthiophene-2-carbonyl)piperazine-1-sulfonyl]-3-(propan-2-yl)-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
6-[4-(5-methylthiophene-2-carbonyl)piperazine-1-sulfonyl]-3-(propan-2-yl)-1,3-benzoxazol-2(3H)-one
6-[4-(5-methylthiophene-2-carbonyl)piperazine-1-sulfonyl]-3-(propan-2-yl)-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | L694-0407 |
| Compound Name: | 6-[4-(5-methylthiophene-2-carbonyl)piperazine-1-sulfonyl]-3-(propan-2-yl)-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 449.55 |
| Molecular Formula: | C20 H23 N3 O5 S2 |
| Smiles: | CC(C)N1C(=O)Oc2cc(ccc12)S(N1CCN(CC1)C(c1ccc(C)s1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1711 |
| logD: | 3.1711 |
| logSw: | -3.5923 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 72.245 |
| InChI Key: | ZTFFAJSGUDWMMH-UHFFFAOYSA-N |