N-(2,4-difluorophenyl)-1-methyl-2,4-dioxo-3-[3-oxo-3-(pyrrolidin-1-yl)propyl]-1,2,3,4-tetrahydroquinazoline-6-sulfonamide
Chemical Structure Depiction of
N-(2,4-difluorophenyl)-1-methyl-2,4-dioxo-3-[3-oxo-3-(pyrrolidin-1-yl)propyl]-1,2,3,4-tetrahydroquinazoline-6-sulfonamide
N-(2,4-difluorophenyl)-1-methyl-2,4-dioxo-3-[3-oxo-3-(pyrrolidin-1-yl)propyl]-1,2,3,4-tetrahydroquinazoline-6-sulfonamide
Compound characteristics
| Compound ID: | L695-0044 |
| Compound Name: | N-(2,4-difluorophenyl)-1-methyl-2,4-dioxo-3-[3-oxo-3-(pyrrolidin-1-yl)propyl]-1,2,3,4-tetrahydroquinazoline-6-sulfonamide |
| Molecular Weight: | 492.5 |
| Molecular Formula: | C22 H22 F2 N4 O5 S |
| Smiles: | CN1C(N(CCC(N2CCCC2)=O)C(c2cc(ccc12)S(Nc1ccc(cc1F)F)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1252 |
| logD: | 0.643 |
| logSw: | -3.2026 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.993 |
| InChI Key: | JUFAIVSQJGUZAD-UHFFFAOYSA-N |