3-methyl-6-[4-(thiophene-2-carbonyl)piperazine-1-sulfonyl]-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
3-methyl-6-[4-(thiophene-2-carbonyl)piperazine-1-sulfonyl]-1,3-benzoxazol-2(3H)-one
3-methyl-6-[4-(thiophene-2-carbonyl)piperazine-1-sulfonyl]-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | L694-0071 |
| Compound Name: | 3-methyl-6-[4-(thiophene-2-carbonyl)piperazine-1-sulfonyl]-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 407.47 |
| Molecular Formula: | C17 H17 N3 O5 S2 |
| Smiles: | CN1C(=O)Oc2cc(ccc12)S(N1CCN(CC1)C(c1cccs1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6349 |
| logD: | 1.6349 |
| logSw: | -2.5252 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 72.29 |
| InChI Key: | IRMOXULGJYMPEP-UHFFFAOYSA-N |