[5-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-1,2-benzoxazol-3-yl](piperidin-1-yl)methanone
Chemical Structure Depiction of
[5-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-1,2-benzoxazol-3-yl](piperidin-1-yl)methanone
[5-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-1,2-benzoxazol-3-yl](piperidin-1-yl)methanone
Compound characteristics
| Compound ID: | L995-0403 |
| Compound Name: | [5-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-1,2-benzoxazol-3-yl](piperidin-1-yl)methanone |
| Molecular Weight: | 425.51 |
| Molecular Formula: | C22 H23 N3 O4 S |
| Smiles: | C1CCN(CC1)C(c1c2cc(ccc2on1)S(N1CCc2ccccc2C1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6105 |
| logD: | 3.6105 |
| logSw: | -3.7756 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 70.459 |
| InChI Key: | BBAVETMXWMMGOE-UHFFFAOYSA-N |