N-[(4-chlorophenyl)methyl]-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-[(4-chlorophenyl)methyl]-1-methyl-2,4-dioxo-3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1,2,3,4-tetrahydroquinazoline-6-sulfonamide
N-[(4-chlorophenyl)methyl]-1-methyl-2,4-dioxo-3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1,2,3,4-tetrahydroquinazoline-6-sulfonamide
Compound characteristics
| Compound ID: | L596-0033 |
| Compound Name: | N-[(4-chlorophenyl)methyl]-1-methyl-2,4-dioxo-3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1,2,3,4-tetrahydroquinazoline-6-sulfonamide |
| Molecular Weight: | 490.96 |
| Molecular Formula: | C22 H23 Cl N4 O5 S |
| Smiles: | CN1C(N(CC(N2CCCC2)=O)C(c2cc(ccc12)S(NCc1ccc(cc1)[Cl])(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2649 |
| logD: | 2.264 |
| logSw: | -3.5878 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.821 |
| InChI Key: | NECVSSVJPMKGLD-UHFFFAOYSA-N |