6-[4-(3,4-dimethoxybenzoyl)piperazine-1-sulfonyl]-3-(propan-2-yl)-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
6-[4-(3,4-dimethoxybenzoyl)piperazine-1-sulfonyl]-3-(propan-2-yl)-1,3-benzoxazol-2(3H)-one
6-[4-(3,4-dimethoxybenzoyl)piperazine-1-sulfonyl]-3-(propan-2-yl)-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | L694-0426 |
| Compound Name: | 6-[4-(3,4-dimethoxybenzoyl)piperazine-1-sulfonyl]-3-(propan-2-yl)-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 489.55 |
| Molecular Formula: | C23 H27 N3 O7 S |
| Smiles: | CC(C)N1C(=O)Oc2cc(ccc12)S(N1CCN(CC1)C(c1ccc(c(c1)OC)OC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.939 |
| logD: | 1.939 |
| logSw: | -2.7715 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 86.487 |
| InChI Key: | MTNQGMJGKGGCPJ-UHFFFAOYSA-N |