N-(3-chloro-2-methylphenyl)-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-(3-chloro-2-methylphenyl)-1-methyl-2,4-dioxo-3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1,2,3,4-tetrahydroquinazoline-6-sulfonamide
N-(3-chloro-2-methylphenyl)-1-methyl-2,4-dioxo-3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1,2,3,4-tetrahydroquinazoline-6-sulfonamide
Compound characteristics
| Compound ID: | L596-0090 |
| Compound Name: | N-(3-chloro-2-methylphenyl)-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: | Cc1c(cccc1[Cl])NS(c1ccc2c(c1)C(N(CC(N1CCCC1)=O)C(N2C)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.694 |
| logD: | 2.4386 |
| logSw: | -3.6023 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.014 |
| InChI Key: | ZSJFATPACCHPNT-UHFFFAOYSA-N |