6-{4-[4-(furan-2-carbonyl)piperazine-1-carbonyl]piperidine-1-sulfonyl}-3-methyl-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
6-{4-[4-(furan-2-carbonyl)piperazine-1-carbonyl]piperidine-1-sulfonyl}-3-methyl-1,3-benzoxazol-2(3H)-one
6-{4-[4-(furan-2-carbonyl)piperazine-1-carbonyl]piperidine-1-sulfonyl}-3-methyl-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | C648-0807 |
| Compound Name: | 6-{4-[4-(furan-2-carbonyl)piperazine-1-carbonyl]piperidine-1-sulfonyl}-3-methyl-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 502.55 |
| Molecular Formula: | C23 H26 N4 O7 S |
| Smiles: | CN1C(=O)Oc2cc(ccc12)S(N1CCC(CC1)C(N1CCN(CC1)C(c1ccco1)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8902 |
| logD: | 0.8902 |
| logSw: | -2.2534 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 96.498 |
| InChI Key: | VPUFQOSDMOADHB-UHFFFAOYSA-N |