3-methyl-6-[4-(1-methyl-1H-pyrazole-5-carbonyl)piperazine-1-sulfonyl]-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
3-methyl-6-[4-(1-methyl-1H-pyrazole-5-carbonyl)piperazine-1-sulfonyl]-1,3-benzoxazol-2(3H)-one
3-methyl-6-[4-(1-methyl-1H-pyrazole-5-carbonyl)piperazine-1-sulfonyl]-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | L694-0143 |
| Compound Name: | 3-methyl-6-[4-(1-methyl-1H-pyrazole-5-carbonyl)piperazine-1-sulfonyl]-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 405.43 |
| Molecular Formula: | C17 H19 N5 O5 S |
| Smiles: | CN1C(=O)Oc2cc(ccc12)S(N1CCN(CC1)C(c1ccnn1C)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.0491 |
| logD: | 0.0491 |
| logSw: | -2.1933 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 84.922 |
| InChI Key: | DOIBHBVEEIXNKW-UHFFFAOYSA-N |