{4-[4-(2,3-dihydro-1,4-benzodioxine-6-sulfonyl)piperazin-1-yl]-3-nitrophenyl}(morpholin-4-yl)methanone
Chemical Structure Depiction of
{4-[4-(2,3-dihydro-1,4-benzodioxine-6-sulfonyl)piperazin-1-yl]-3-nitrophenyl}(morpholin-4-yl)methanone
{4-[4-(2,3-dihydro-1,4-benzodioxine-6-sulfonyl)piperazin-1-yl]-3-nitrophenyl}(morpholin-4-yl)methanone
Compound characteristics
| Compound ID: | 8017-5715 |
| Compound Name: | {4-[4-(2,3-dihydro-1,4-benzodioxine-6-sulfonyl)piperazin-1-yl]-3-nitrophenyl}(morpholin-4-yl)methanone |
| Molecular Weight: | 518.54 |
| Molecular Formula: | C23 H26 N4 O8 S |
| Smiles: | C1CN(CCN1c1ccc(cc1[N+]([O-])=O)C(N1CCOCC1)=O)S(c1ccc2c(c1)OCCO2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.7472 |
| logD: | 0.7472 |
| logSw: | -2.3711 |
| Hydrogen bond acceptors count: | 14 |
| Polar surface area: | 108.369 |
| InChI Key: | GCMLONQWWQSVKJ-UHFFFAOYSA-N |