3-[2-(azepan-1-yl)-2-oxoethyl]-1-methyl-6-(pyrrolidine-1-sulfonyl)quinazoline-2,4(1H,3H)-dione
Chemical Structure Depiction of
3-[2-(azepan-1-yl)-2-oxoethyl]-1-methyl-6-(pyrrolidine-1-sulfonyl)quinazoline-2,4(1H,3H)-dione
3-[2-(azepan-1-yl)-2-oxoethyl]-1-methyl-6-(pyrrolidine-1-sulfonyl)quinazoline-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | L596-0469 |
| Compound Name: | 3-[2-(azepan-1-yl)-2-oxoethyl]-1-methyl-6-(pyrrolidine-1-sulfonyl)quinazoline-2,4(1H,3H)-dione |
| Molecular Weight: | 448.54 |
| Molecular Formula: | C21 H28 N4 O5 S |
| Smiles: | CN1C(N(CC(N2CCCCCC2)=O)C(c2cc(ccc12)S(N1CCCC1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5437 |
| logD: | 1.5437 |
| logSw: | -2.6574 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 80.104 |
| InChI Key: | ACRFDJJRJKVVHV-UHFFFAOYSA-N |