N-(2,3-dimethylphenyl)-1-methyl-2,4-dioxo-3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1,2,3,4-tetrahydroquinazoline-6-sulfonamide
Chemical Structure Depiction of
N-(2,3-dimethylphenyl)-1-methyl-2,4-dioxo-3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1,2,3,4-tetrahydroquinazoline-6-sulfonamide
N-(2,3-dimethylphenyl)-1-methyl-2,4-dioxo-3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1,2,3,4-tetrahydroquinazoline-6-sulfonamide
Compound characteristics
| Compound ID: | L596-0047 |
| Compound Name: | N-(2,3-dimethylphenyl)-1-methyl-2,4-dioxo-3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1,2,3,4-tetrahydroquinazoline-6-sulfonamide |
| Molecular Weight: | 470.55 |
| Molecular Formula: | C23 H26 N4 O5 S |
| Smiles: | Cc1cccc(c1C)NS(c1ccc2c(c1)C(N(CC(N1CCCC1)=O)C(N2C)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5171 |
| logD: | 2.5141 |
| logSw: | -3.0768 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.014 |
| InChI Key: | IIHHQBZXRQOXKL-UHFFFAOYSA-N |