3-[2-(azepan-1-yl)-2-oxoethyl]-N-[(furan-2-yl)methyl]-1-methyl-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-6-sulfonamide
Chemical Structure Depiction of
3-[2-(azepan-1-yl)-2-oxoethyl]-N-[(furan-2-yl)methyl]-1-methyl-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-6-sulfonamide
3-[2-(azepan-1-yl)-2-oxoethyl]-N-[(furan-2-yl)methyl]-1-methyl-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-6-sulfonamide
Compound characteristics
| Compound ID: | L596-0453 |
| Compound Name: | 3-[2-(azepan-1-yl)-2-oxoethyl]-N-[(furan-2-yl)methyl]-1-methyl-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-6-sulfonamide |
| Molecular Weight: | 474.53 |
| Molecular Formula: | C22 H26 N4 O6 S |
| Smiles: | CN1C(N(CC(N2CCCCCC2)=O)C(c2cc(ccc12)S(NCc1ccco1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9074 |
| logD: | 1.9067 |
| logSw: | -2.9892 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 97.535 |
| InChI Key: | YEPLNURIKJFUHP-UHFFFAOYSA-N |